SCHEMBL6807435

SCHEMBL6807435

O=c1ccc2cnc(Nc3c(F)cc(F)cc3F)nc2n1C1CCCC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 19/20 0.65
CDK2 P24941 17/20 0.65
CDK4 P11802 16/20 0.65
CCND2 P30279 12/20 0.65
CCND3 P30281 12/20 0.65
CCNA2 P20248 10/20 0.65
FGFR1 P11362 6/20 0.65
FGFR2 P21802 6/20 0.65
FGFR4 P22455 6/20 0.65
FGFR3 P22607 6/20 0.65
CCNA1 P78396 8/20 0.62
CCNE1 P24864 12/20 0.59
CCNE2 O96020 5/20 0.59
CCNB2 O95067 3/20 0.59
CDK1 P06493 3/20 0.59
CCNB1 P14635 3/20 0.59
CCNB3 Q8WWL7 3/20 0.59
PAK4 O96013 1/20 0.56
PAK1 Q13153 1/20 0.56
PKN1 Q16512 1/20 0.56

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
SCHEMBL6807752 0.88 CCND1 (0.73) CCND1CDK2CDK4CCND2CCND3
SCHEMBL5265457 0.83 CCND1 (0.79) CCND1CDK2CDK4CCND2CCND3
SCHEMBL5264679 0.83 CCND1 (0.79) CCND1CDK2CDK4CCND2CCND3
SCHEMBL6812932 0.83 CCND1 (0.61) CCND1CDK2CDK4CCND2CCND3
SCHEMBL6808407 0.79 CDK4 (0.64) CCND1CDK2CDK4CCND2CCND3
SCHEMBL5263407 0.79 CDK4 (1.00) CCND1CDK2CDK4CCND2CCND3
SCHEMBL6804918 0.79 CCND1 (0.73) CCND1CDK2CDK4CCND2CCND3
SCHEMBL6808989 0.79 CDK4 (0.63) CCND1CDK2CDK4CCND2CCND3
SCHEMBL5262469 0.78 CDK4 (1.00) CCND1CDK2CDK4CCND2CCND3
SCHEMBL5262750 0.78 CDK4 (1.00) CCND1CDK2CDK4CCND2CCND3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040224958-A1 Pyridopyrimidinone derivatives for treatment of neurodegenerative disease BOOTH RICHARD JOHN (US) 2004-11-11 US claimed
EP-1255755-A1 PYRIDOPYRIMIDINONE DERIVATIVES FOR TREATMENT OF NEURODEGENERATIVE DISEASE WARNER-LAMBERT COMPANY (US) 2002-11-13 EP claimed
WO-2001055148-A1 PYRIDOPYRIMIDINONE DERIVATIVES FOR TREATMENT OF NEURODEGENERATIVE DISEASE WARNER-LAMBERT COMPANY (US) 2001-08-02 WO claimed
US-20040224958-A1 Pyridopyrimidinone derivatives for treatment of neurodegenerative disease BOOTH RICHARD JOHN (US) 2004-11-11 US disclosed
EP-1255755-A1 PYRIDOPYRIMIDINONE DERIVATIVES FOR TREATMENT OF NEURODEGENERATIVE DISEASE WARNER-LAMBERT COMPANY (US) 2002-11-13 EP disclosed
WO-2001055148-A1 PYRIDOPYRIMIDINONE DERIVATIVES FOR TREATMENT OF NEURODEGENERATIVE DISEASE WARNER-LAMBERT COMPANY (US) 2001-08-02 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 (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-20040224958-A1 Pyridopyrimidinone derivatives for treatment of neurodegenerative disease CDK4, CDKL1, CCNT1 CCND1 23/4885CDK2 11/4885CDK4 1/4885

“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.