SCHEMBL6479700

SCHEMBL6479700

Cn1c(C(C)(C)C)nc2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.58
ALOX15 P16050 2/20 0.56
ATM Q13315 1/20 0.53
MAPT P10636 3/20 0.48
TP53 P04637 2/20 0.48
KDM4E B2RXH2 5/20 0.47
ALDH1A1 P00352 4/20 0.47
RAB9A P51151 4/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
HTT P42858 1/20 0.47
CNR2 P34972 1/20 0.47
ACSS2 Q9NR19 1/20 0.46
METAP2 P50579 1/20 0.46
METAP1 P53582 1/20 0.46
NPC1 O15118 3/20 0.46
PKM P14618 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
GAA P10253 2/20 0.46
TSHR P16473 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7023960 0.85 ALOX15 (0.55) SMN1; SMN2ALOX15ATMMAPTTP53
SCHEMBL6479789 0.85 SMN1; SMN2 (0.59) SMN1; SMN2ALOX15ATMMAPTKDM4E
SCHEMBL38664142 0.85 ALOX15 (0.57) SMN1; SMN2ALOX15ATMMAPTTP53
SCHEMBL6493316 0.85 SMN1; SMN2 (0.55) SMN1; SMN2ALOX15ATMMAPTKDM4E
SCHEMBL10969560 0.84 SMN1; SMN2 (0.57) SMN1; SMN2ALOX15ATMMAPTTP53
SCHEMBL30034162 0.82 SMN1; SMN2 (0.55) SMN1; SMN2ALOX15ATMMAPTTP53
SCHEMBL8799913 0.82 SMN1; SMN2 (0.60) SMN1; SMN2ALOX15ATMMAPTTP53
SCHEMBL5851401 0.82 SMN1; SMN2 (0.55) SMN1; SMN2ALOX15ATMMAPTTP53
SCHEMBL20283874 0.82 SMN1; SMN2 (0.52) SMN1; SMN2ALOX15ATMMAPTTP53
SCHEMBL13104750 0.82 SMN1; SMN2 (0.52) SMN1; SMN2ALOX15ATMMAPTTP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 196 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043613-B2 Inhibitors of SARM1 DISARM THERAPEUTICS, INC. (US) 2024-07-23 US disclosed
US-12043613-B2 Inhibitors of SARM1 DISARM THERAPEUTICS, INC. (US) 2024-07-23 US disclosed
US-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-06-27 US disclosed
US-20240208927-A1 WNT SIGNALING PATHWAY INHIBITORS FOR TREATMENTS OF DISEASE UNIVERSITY OF MARYLAND, BALTIMORE 2024-06-27 US disclosed
US-11912712-B2 Organic electroluminescent element having an organic compound BEIJING BAYI SPACE LIQUID CRYSTAL TECHNOLOGY CO. LTD. (CN) 2024-02-27 US disclosed
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-10-31 US disclosed
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-10-31 US disclosed
US-20230321100-A1 CD73 INHIBITOR AND APPLICATION THEREOF IN MEDICINE BETTA PHARMACEUTICALS CO., LTD (CN) 2023-10-12 US disclosed
US-20230286992-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENT BEIJING BAYI SPACE LIQUID CRYSTAL TECHNOLOGY CO. LTD. (CN) 2023-09-14 US disclosed
US-11700768-B2 Compound and organic light emitting device comprising the same LG CHEM, LTD. (KR) 2023-07-11 US disclosed
US-20080188474-A1 e.g. 1-phenyl-N3-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-1H-1,2,4-triazole-3,5-diamine; receptor protein tyrosine kinase (AXL) antagonist; antiinflammatory, anticarcinogenic , antidiabetic agent; rheumatoid arthritis, vascular disease; breast, renal, endometrial, ovarian carcinoma, or myeloid leukemia RIGEL PHARMACEUTICALS, INC. (US) 2008-08-07 US disclosed
US-20070238740-A1 Nitrosated And Nitrosylated Cardiovascular Compounds, Compositions And Methods Of Use NITROMED, INC. (US) 2007-10-11 US disclosed
US-7262223-B2 Amidine derivatives for treating amyloidosis NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-08-28 US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 US disclosed
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands SCHERING CORPORATION 2007-02-22 US disclosed
US-20070032533-A1 Nitric oxide enhancing angiotensin II antagonist compounds, compositions and methods of use NITROMED, INC. (US) 2007-02-08 US disclosed
US-20070027166-A1 Pyrazolo pyrimidines useful as aurora kinase inhibitors SUNESIS PHARMACEUTICALS, INC. 2007-02-01 US disclosed
US-20070021483-A1 Amidine derivatives for treating amyloidosis NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-01-25 US disclosed
US-6962938-B2 Spiro-cyclic β-amino acid derivatives as inhibitors of matrix metalloproteases and TNF-α converting enzyme (TACE) BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-11-08 US disclosed
US-6720329-B2 ANTIINFLAMMATORY AGENTS BRISTOL-MYERS SQUIBB PHARMA 2004-04-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230286992-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC ELECTROLUMINESCENT ELEMENT SLCO4C1, SLCO1A2, SLCO2A1 SMN1; SMN2 805/4885ALOX15 1609/4885ATM 3633/4885
US-11700768-B2 Compound and organic light emitting device comprising the same ARL1, ARRB1, CRY1 SMN1; SMN2 3394/4885ALOX15 1345/4885ATM 1312/4885
US-11912712-B2 Organic electroluminescent element having an organic compound SLCO4C1, SLCO1A2, SLCO2A1 SMN1; SMN2 869/4885ALOX15 1895/4885ATM 4036/4885
US-12043613-B2 Inhibitors of SARM1 SARM1, SMN1; SMN2, SARNP SMN1; SMN2 2/4885ALOX15 4085/4885ATM 355/4885
US-20230321100-A1 CD73 INHIBITOR AND APPLICATION THEREOF IN MEDICINE ENTPD5, ENTPD1, NT5E SMN1; SMN2 4189/4885ALOX15 1012/4885ATM 3148/4885
US-20240208902-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP SMN1; SMN2 1934/4885ALOX15 47/4885ATM 3465/4885
US-20070027166-A1 Pyrazolo pyrimidines useful as aurora kinase inhibitors AURKA, AURKB, AURKC SMN1; SMN2 4374/4885ALOX15 4703/4885ATM 150/4885
US-20070238740-A1 Nitrosated And Nitrosylated Cardiovascular Compounds, Compositions And Methods Of Use REN, ECE1, EDNRA SMN1; SMN2 2836/4885ALOX15 261/4885ATM 4533/4885
US-11802111-B2 Cyclobutyl amide monoacylglycerol lipase modulators MGLL, LPL, PNLIP SMN1; SMN2 1908/4885ALOX15 42/4885ATM 3517/4885
US-20070043045-A1 Novel high affinity thiophene-based and furan-based kinase ligands CDKL2, CDK2, CDKL1 SMN1; SMN2 2211/4885ALOX15 2839/4885ATM 873/4885
US-20070032533-A1 Nitric oxide enhancing angiotensin II antagonist compounds, compositions and methods of use AGTR2, AGTR1, REN SMN1; SMN2 2701/4885ALOX15 491/4885ATM 2194/4885
US-20240208927-A1 WNT SIGNALING PATHWAY INHIBITORS FOR TREATMENTS OF DISEASE WNT1, CTNNB1, WNT3A SMN1; SMN2 2078/4885ALOX15 2753/4885ATM 1516/4885
US-20070021483-A1 Amidine derivatives for treating amyloidosis APP, IAPP, GRN SMN1; SMN2 19/4885ALOX15 1153/4885ATM 2868/4885
US-20080188474-A1 e.g. 1-phenyl-N3-(4-(2-(piperidin-1-yl)ethoxy)phenyl)-1H-1,2,4-triazole-3,5-diamine; receptor protein tyrosine kinase (AXL) antagonist; antiinflammatory, anticarcinogenic , antidiabetic agent; rheumatoid arthritis, vascular disease; breast, renal, endometrial, ovarian carcinoma, or myeloid leukemia AXL, TYRO3, FLT3 SMN1; SMN2 4804/4885ALOX15 2239/4885ATM 995/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.