SCHEMBL3968460

SCHEMBL3968460

CCN1C(=O)N(c2c(C)c(OC)cc(OC)c2C)Cc2cnc(Nc3ccc(N4CCN(C(=O)CN)CC4)cc3)cc21

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 2/20 0.45
CDK4 P11802 2/20 0.45
CCNB1 P14635 2/20 0.45
CCND1 P24385 2/20 0.45
CCNE1 P24864 2/20 0.45
CDK2 P24941 2/20 0.45
FGFR2 P21802 3/20 0.45
FGFR3 P22607 2/20 0.45
FGFR4 P22455 16/20 0.44
FGFR1 P11362 14/20 0.44

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
SCHEMBL3968497 0.92 FGFR4 (0.52) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3967144 0.91 CDK1 (0.43) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3970268 0.88 FGFR3 (0.47) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3976966 0.86 CDK1 (0.53) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3975654 0.86 FGFR3 (0.46) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3971204 0.81 FGFR1 (0.53) FGFR2FGFR3FGFR4FGFR1
SCHEMBL3971306 0.79 FGFR4 (0.53) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3968636 0.78 EGFR (0.53) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3971767 0.74 FGFR4 (0.62) CDK1CDK4CCNB1CCND1CCNE1
SCHEMBL3976088 0.74 FGFR4 (0.53) CDK1CDK4CCNB1CCND1CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1801112-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation Warner-Lambert Company LLC (US) 2007-06-27 EP claimed
US-7501425-B1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyprimidines as inhibitors of cellular proliferation WARNER LAMBERT COMPANY (US) 2009-03-10 US disclosed
EP-1801112-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation Warner-Lambert Company LLC (US) 2007-06-27 EP disclosed
US-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation DOBRUSIN ELLEN MYRA (US) 2004-03-04 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 (1 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-20040044012-A1 Bicyclic pyrimidines and bicyclic 3,4-dihydropyrimidines as inhibitors of cellular proliferation CCNI, CCNH, CCNA1 CDK1 11/4885CDK4 4/4885CCNB1 24/4885

“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.