SCHEMBL5875603

SCHEMBL5875603

CCOC(OCC)(OCC)c1ccc2c(-c3ccnc(NC4CCCC4)n3)c(-c3ccc(F)cc3)nn2c1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.44
CDK4 P11802 2/20 0.44
MAPK10 P53779 4/20 0.42
GSK3B P49841 6/20 0.41
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
MAPK8 P45983 4/20 0.38
MAPK9 P45984 4/20 0.38
PRKD3 O94806 1/20 0.38
MAP4K4 O95819 1/20 0.38
MAPK1 P28482 1/20 0.38
CSNK1A1 P48729 1/20 0.38
CLK2 P49760 1/20 0.38
GSK3A P49840 1/20 0.38
CSNK1G2 P78368 1/20 0.38
TAOK1 Q7L7X3 1/20 0.38
MINK1 Q8N4C8 1/20 0.38
AURKB Q96GD4 1/20 0.38

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
SCHEMBL5890537 0.91 CSNK1D (0.44) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5890942 0.88 GSK3B (0.48) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5875520 0.83 CSNK1D (0.43) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5875496 0.83 CSNK1D (0.45) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5890927 0.80 CDK4 (0.49) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5890920 0.80 CSNK1D (0.50) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5875488 0.79 CSNK1D (0.46) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5461798 0.79 MAPK14 (0.53) CSNK1DCDK4MAPK10GSK3BMAPK13
SCHEMBL5875489 0.78 CSNK1D (0.44) CSNK1DCDK4GSK3BMAPK13MAPK12
SCHEMBL5449622 0.78 CSNK1D (0.53) CSNK1DCDK4MAPK10GSK3BMAPK13

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109209-B2 Pyrazolopyridines, process for their preparation and use as therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-09-19 US disclosed
US-7034030-B2 Pyralopyridines, process for their preparation and use as therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-04-25 US disclosed
US-7030134-B2 Pyrazolopyridinyl pyridine and pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-04-18 US disclosed
US-20060058319-A1 Pyrazolopyridines, process for their preparation and use as therapeutic compounds ALBERTI MICHAEL J 2006-03-16 US disclosed
US-6962914-B2 Pyrazolopyridinyl pyridine and pyrimidine therapeutic compounds SMITHKLINE BEECHAM CORPORATION (US) 2005-11-08 US disclosed
US-20050192303-A1 Pyrazolopyridinyl pyridine and pyrimidine therapeutic compounds GUDMUNDSSON KRISTJAN (US) 2005-09-01 US disclosed
EP-1385847-B1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES SMITHKLINE BEECHAM CORP (US) 2005-06-01 EP disclosed
US-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-05-19 US disclosed
US-20050059677-A1 Pyralopyridines, process for their preparation and use as therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2005-03-17 US disclosed
US-20040142941-A1 Therapeutic compounds SMITHKLINE BEECHAM CORPORATION 2004-07-22 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 (5 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-20040142941-A1 Therapeutic compounds PCSK9, ABCB1, ABCB11 CSNK1D 466/4885CDK4 2345/4885MAPK10 2318/4885
US-20050059677-A1 Pyralopyridines, process for their preparation and use as therapeutic compounds CYP3A5, CYP3A4, CYP2C19 CSNK1D 1070/4885CDK4 766/4885MAPK10 2668/4885
US-20060058319-A1 Pyrazolopyridines, process for their preparation and use as therapeutic compounds CYP3A5, CYP3A4, CYP3A7 CSNK1D 542/4885CDK4 618/4885MAPK10 2405/4885
US-20050107400-A1 Use of pyrazolopyridines as therapeutic compounds QDPR, DPYD, ENTPD5 CSNK1D 2789/4885CDK4 439/4885MAPK10 2996/4885
US-20050192303-A1 Pyrazolopyridinyl pyridine and pyrimidine therapeutic compounds DPYD, TYMP, P2RY4 CSNK1D 479/4885CDK4 115/4885MAPK10 2460/4885

“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.