SCHEMBL152157

SCHEMBL152157

[c]1ncc2c(n1)CCCCCC2

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 2/20 0.32
CDK5R1 Q15078 2/20 0.32
SIGMAR1 Q99720 1/20 0.31
CCNA2 P20248 1/20 0.30
CDK2 P24941 1/20 0.30
GRM5 P41594 1/20 0.30

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
SCHEMBL4148663 1.00 CDK5 (0.32) CDK5CDK5R1SIGMAR1CCNA2CDK2
SCHEMBL159386 0.98 CDK5 (0.33) CDK5CDK5R1SIGMAR1CCNA2CDK2
SCHEMBL558013 0.93
SCHEMBL557652 0.74 PLK1 (0.41) GRM5
SCHEMBL1593106 0.69 HTR2C (0.41)
SCHEMBL190720 0.69 POLB (0.39)
SCHEMBL4141897 0.65 OR51E2 (0.32)
SCHEMBL22694432 0.65
SCHEMBL3341697 0.65 NNMT (0.38)
SCHEMBL910531 0.65

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 1975 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170050970-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS, INC. 2017-02-23 US claimed
US-20140024661-A1 FUSED PYRIMIDINES AND SUBSTITUTED QUINAZOLINES AS INHIBITORS OF P97 CLEAVE BIOSCIENCES, INC. (US) 2014-01-23 US claimed
WO-2024151489-A1 PHARMACEUTICAL PYRIDYL COMPOSITIONS AND METHODS FOR USE Unicycive Therapeutics Inc. (US) 2024-07-18 WO disclosed
US-20240239797-A1 AKT1 MODULATORS ALTEROME THERAPEUTICS, INC. 2024-07-18 US disclosed
US-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2024-07-18 US disclosed
US-12036078-B2 Oral products and methods for producing the same PolySpectra, Inc. (US) 2024-07-16 US disclosed
US-12036211-B2 Nicorandil derivatives Unicycive Therapeutics Inc. (US) 2024-07-16 US disclosed
WO-2024148191-A1 MODULATORS OF TNF-α ACTIVITY FORWARD THERAPEUTICS, INC. (US) 2024-07-11 WO disclosed
US-12030870-B2 Benzamides of pyrazolylamino-pyrimidinyl derivatives, and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-07-09 US disclosed
US-12029708-B2 Alkoxy compounds for disease treatment ACUCELA INC. (US) 2024-07-09 US disclosed
CN-118290403-A Benzamide derivatives of pyrazolyl-amino-pyrimidinyl and compositions and methods thereof 凌科药业(杭州)有限公司 2024-07-05 CN disclosed
WO-2009002984-A2 STABLE AND COMPATIBLE POLYMER BLENDS AEGIS BIOSCIENCES LLP (US) 2008-12-31 WO disclosed
US-20080316678-A1 Nanoparticle ultracapacitor DAIS ANALYTIC CORPORATION 2008-12-25 US disclosed
WO-2008141179-A1 MOLECULE SULFONATION PROCESS AEGIS BIOSCIENCES LLP (US) 2008-11-20 WO disclosed
WO-2008131368-A2 STYRENYL DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. (US) 2008-10-30 WO disclosed
US-20080227789-A1 DIAMINOTHIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2008-09-18 US disclosed
US-20080188454-A1 angiogenesis and/or cell proliferation, carcinoma, myeloid leukemia, endometriosis; inhibitors of the receptor protein tyrosine kinase; N3-(3-cyclopentyl-1,2,3,4,5,6-hexahydrobenzo[d]azocin-8-yl)-1-(6-fluoroquinazolin-4-yl)-1H-1,2,4-triazole-3,5-diamine RIGEL PHARMACEUTICALS, INC. (US) 2008-08-07 US disclosed
WO-2008089484-A1 MULTI-PHASE SELECTIVE MASS TRANSFER THROUGH A MEMBRANE DAIS ANALYTIC CORPORATION (US) 2008-07-24 WO disclosed
WO-2008080134-A2 4-AMIN0-2- (HETERO) ARYLAMINO-5- (HETERO) ARYLTHIAZOLES USEFUL AS AXL INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2008-07-03 WO disclosed
WO-2008039779-A2 ENHANCED HVAC SYSTEM AND METHOD DAIS ANALYTIC CORPORATION (US) 2008-04-03 WO 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 (10 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-20240239797-A1 AKT1 MODULATORS AKT1S1, AKT1, AKT2 CDK5 310/4885CDK5R1 313/4885SIGMAR1 4555/4885
US-12029708-B2 Alkoxy compounds for disease treatment ALDH1A2, CLN6, AGER CDK5 1029/4885CDK5R1 1325/4885SIGMAR1 3515/4885
US-20170050970-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE BTK, LYN, LCK CDK5 260/4885CDK5R1 554/4885SIGMAR1 4702/4885
US-20140024661-A1 FUSED PYRIMIDINES AND SUBSTITUTED QUINAZOLINES AS INHIBITORS OF P97 PSMG3, PSMD1, PSMD3 CDK5 723/4885CDK5R1 818/4885SIGMAR1 3200/4885
US-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF FAP, FIBP, FGFR1 CDK5 1284/4885CDK5R1 2059/4885SIGMAR1 4804/4885
US-12036211-B2 Nicorandil derivatives NAPRT, NQO1, NME4 CDK5 452/4885CDK5R1 435/4885SIGMAR1 2279/4885
US-12030870-B2 Benzamides of pyrazolylamino-pyrimidinyl derivatives, and compositions and methods thereof JAK2, JAK1, JAK3 CDK5 127/4885CDK5R1 364/4885SIGMAR1 3383/4885
US-20080227789-A1 DIAMINOTHIAZOLES USEFUL AS AXL INHIBITORS AXL, TYRO3, MERTK CDK5 194/4885CDK5R1 158/4885SIGMAR1 2675/4885
US-12036078-B2 Oral products and methods for producing the same CROCC, RPAP1, RUVBL1 CDK5 583/4885CDK5R1 373/4885SIGMAR1 4324/4885
US-20080188454-A1 angiogenesis and/or cell proliferation, carcinoma, myeloid leukemia, endometriosis; inhibitors of the receptor protein tyrosine kinase; N3-(3-cyclopentyl-1,2,3,4,5,6-hexahydrobenzo[d]azocin-8-yl)-1-(6-fluoroquinazolin-4-yl)-1H-1,2,4-triazole-3,5-diamine AXL, FLT3, FLT1 CDK5 92/4885CDK5R1 102/4885SIGMAR1 2307/4885

“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.