SCHEMBL463027

SCHEMBL463027

Cc1cn(C)c2ncnc(N)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADK P55263 1/20 0.48
ADORA2A P29274 2/20 0.47
ADORA1 P30542 2/20 0.47
SRC P12931 5/20 0.44
LRRK2 Q5S007 2/20 0.44
EGFR P00533 4/20 0.43
CDK1 P06493 1/20 0.43
PI4KB Q9UBF8 3/20 0.42
PI4KA P42356 2/20 0.42
PI4K2B Q8TCG2 2/20 0.42
PI4K2A Q9BTU6 2/20 0.42
DYRK1A Q13627 1/20 0.41
KDR P35968 3/20 0.41
ABL1 P00519 2/20 0.41
MTOR P42345 2/20 0.41
PIK3CD O00329 1/20 0.41
HCK P08631 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41

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
SCHEMBL19304156 0.80 SRC (0.62) ADKSRCEGFRPI4KBPI4KA
SCHEMBL23266428 0.80 ADORA2A (0.43) ADORA2AADORA1SRCLRRK2EGFR
SCHEMBL6935760 0.80 ADORA2A (0.33) ADKADORA2AADORA1SRC
SCHEMBL23735270 0.79 ADK (0.47) ADKADORA2AADORA1SRCLRRK2
SCHEMBL13192053 0.79 ADORA2A (0.46) ADORA2AADORA1SRCLRRK2EGFR
SCHEMBL6430725 0.79 EIF2AK3 (0.46) ADORA2AADORA1LRRK2PI4KBPI4KA
SCHEMBL1585102 0.79 ADK (0.49) ADKADORA2AADORA1LRRK2PI4KB
SCHEMBL869181 0.79 ADK (0.49) ADKADORA2AADORA1SRCLRRK2
SCHEMBL24072614 0.78 SRC (0.54) ADKADORA2AADORA1SRCLRRK2
SCHEMBL6935719 0.77 ADK (0.48) ADKADORA2AADORA1SRCKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373922-A1 PHENYL-2-HYDROXY-ACETYLAMINO-2-METHYL-PHENYL COMPOUNDS FOR THE TREATMENT OF PANCREATIC CANCER LILLY CO ELI (US) 2023-11-23 US disclosed
US-11786534-B2 Substituted pyrrolo[2,3-d]pyrimidines as EGFR inhibitors TAIHO PHARMACEUTICAL CO., LTD. (JP) 2023-10-17 US disclosed
US-20230303613-A1 3′3′ CYCLIC DINUCLEOTIDES WITH AN ALKENYLENE INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY AS CR, V.V.I. (CZ) 2023-09-28 US disclosed
US-20230303613-A1 3′3′ CYCLIC DINUCLEOTIDES WITH AN ALKENYLENE INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY AS CR, V.V.I. (CZ) 2023-09-28 US disclosed
US-11766447-B2 3′3′-cyclic dinucleotide analogue comprising a cyclopentanyl modified nucleotide as sting modulator INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I. (CZ) 2023-09-26 US disclosed
US-20230265501-A1 PHASE PROTECTIVE REAGENT FLOW ORDERING FIRST-CITIZENS BANK & TRUST COMPANY 2023-08-24 US disclosed
EP-3936514-B1 3'3' CYCLIC DINUCLEOTIDES WITH AN ALKENYLENE INST OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR V V I (CZ) 2023-05-24 EP disclosed
US-11548909-B2 Methods of using nucleotide analogues IsoPlexis Corporation (US) 2023-01-10 US disclosed
US-20220162251-A1 NUCLEOTIDE ANALOGUES QIAGEN SCIENCES, LLC 2022-05-26 US disclosed
US-20220160746-A1 3'3'-CYCLIC DINUCLEOTIDE ANALOGUE COMPRISING A CYCLOPENTANYL MODIFIED NUCLEOTIDE AS STING MODULATOR INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY ASCR, V.V.I (CZ) 2022-05-26 US disclosed
WO-2010009342-A2 INHIBITORS OF BRUTON'S TYROSINE KINASE FOR THE TREATMENT OF SOLID TUMORS PHARMACYCLICS, INC. (US) 2010-01-21 WO disclosed
US-20090325928-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors OSI PHARMACEUTICALS, INC. 2009-12-31 US disclosed
US-20090274698-A1 Combination anti-cancer therapy OSI PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090163468-A1 Fused Bicyclic mTor Inhibitors OSI PHARMACEUTICALS, INC. 2009-06-25 US disclosed
US-7534797-B2 6,6-Bicyclic ring substituted heterobicyclic protein kinase inhibitors OSI PHARMACEUTICALS, INC. (US) 2009-05-19 US disclosed
WO-2008121742-A2 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS, INC. (US) 2008-10-09 WO disclosed
US-20070280928-A1 Combined treatment with an EGFR kinase inhibitor and an agent that sensitizes tumor cells to the effects of EGFR kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-12-06 US disclosed
US-20070254883-A1 Unsaturated mTOR inhibitors OSI PHARMACEUTICALS, INC. 2007-11-01 US disclosed
US-20070203143-A1 PROTEIN KINASE INHIBITORS ABBVIE INC. 2007-08-30 US disclosed
US-20070112005-A1 mammalian Target Of Rapamycin (mTOR) kinase; for treatment of lymphoma or ovarian cancer OSI PHARMACEUTICALS, INC. 2007-05-17 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-20090325928-A1 6,6-Bicyclic Ring Substituted Heterobicyclic Protein Kinase Inhibitors IGF1R, MAP2K7, BRCA1 ADK 790/4885ADORA2A 2660/4885ADORA1 2297/4885
US-11548909-B2 Methods of using nucleotide analogues NT5C3B, SAMHD1, RNGTT ADK 232/4885ADORA2A 365/4885ADORA1 477/4885
US-11766447-B2 3′3′-cyclic dinucleotide analogue comprising a cyclopentanyl modified nucleotide as sting modulator STING1, MAVS, CGAS ADK 455/4885ADORA2A 660/4885ADORA1 1854/4885
US-20090163468-A1 Fused Bicyclic mTor Inhibitors MTOR, RICTOR, MAPKAP1 ADK 3269/4885ADORA2A 4833/4885ADORA1 4808/4885
US-20220160746-A1 3'3'-CYCLIC DINUCLEOTIDE ANALOGUE COMPRISING A CYCLOPENTANYL MODIFIED NUCLEOTIDE AS STING MODULATOR STING1, MAVS, CGAS ADK 492/4885ADORA2A 652/4885ADORA1 1736/4885
US-20090274698-A1 Combination anti-cancer therapy MTOR, RICTOR, AKT1 ADK 512/4885ADORA2A 1742/4885ADORA1 2913/4885
US-20070280928-A1 Combined treatment with an EGFR kinase inhibitor and an agent that sensitizes tumor cells to the effects of EGFR kinase inhibitors EGFR, ERBB2, RICTOR ADK 1525/4885ADORA2A 3623/4885ADORA1 4184/4885
US-20220162251-A1 NUCLEOTIDE ANALOGUES NT5C3B, SAMHD1, DUT ADK 197/4885ADORA2A 268/4885ADORA1 350/4885
US-20230373922-A1 PHENYL-2-HYDROXY-ACETYLAMINO-2-METHYL-PHENYL COMPOUNDS FOR THE TREATMENT OF PANCREATIC CANCER PNLIP, RNASE1, AMY2A ADK 1686/4885ADORA2A 609/4885ADORA1 2354/4885
US-20070112005-A1 mammalian Target Of Rapamycin (mTOR) kinase; for treatment of lymphoma or ovarian cancer MTOR, MAPKAP1, RPS6KA1 ADK 1350/4885ADORA2A 4784/4885ADORA1 4808/4885
US-20070254883-A1 Unsaturated mTOR inhibitors MTOR, RICTOR, MAPKAP1 ADK 2731/4885ADORA2A 4489/4885ADORA1 4032/4885
US-20230303613-A1 3′3′ CYCLIC DINUCLEOTIDES WITH AN ALKENYLENE STING1, CGAS, IRF3 ADK 126/4885ADORA2A 237/4885ADORA1 217/4885
US-11786534-B2 Substituted pyrrolo[2,3-d]pyrimidines as EGFR inhibitors EGFR, ERBB2, ERBB3 ADK 1325/4885ADORA2A 2327/4885ADORA1 1524/4885
US-20070203143-A1 PROTEIN KINASE INHIBITORS PACSIN2, MAP3K20, PHKG1 ADK 249/4885ADORA2A 3311/4885ADORA1 4541/4885

“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.