SCHEMBL5266492

SCHEMBL5266492

CCC(CC)n1c(=O)ccc2cnc(Nc3ccc(N4CCCCC4)cc3)nc21

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 20/20 0.73
CCND1 P24385 20/20 0.73
CCND2 P30279 18/20 0.73
CCND3 P30281 18/20 0.73
CCNA2 P20248 8/20 0.66
CDK2 P24941 8/20 0.66
CCNE2 O96020 6/20 0.66
CCNE1 P24864 6/20 0.66
CCNA1 P78396 6/20 0.66
CCNB2 O95067 4/20 0.66
CDK1 P06493 4/20 0.66
CCNB1 P14635 4/20 0.66
CCNB3 Q8WWL7 4/20 0.66
FGFR1 P11362 4/20 0.66
FGFR2 P21802 4/20 0.66
FGFR4 P22455 4/20 0.66
FGFR3 P22607 4/20 0.66
PAK4 O96013 1/20 0.55
PAK1 Q13153 1/20 0.55
PKN1 Q16512 1/20 0.55

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
SCHEMBL5263457 0.91 CDK4 (0.80) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5265726 0.88 CDK4 (0.67) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5267931 0.88 CDK4 (0.67) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5263748 0.87 CDK4 (0.66) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5264068 0.85 CDK4 (0.67) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5263031 0.85 CDK4 (0.66) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5265812 0.84 CDK4 (0.65) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5264164 0.84 CDK4 (0.66) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5268402 0.84 CDK4 (0.65) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5265196 0.84 CDK4 (0.64) CDK4CCND1CCND2CCND3CCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1806348-A2 Pyrido (2,3-D)Pyrimidines as inhibitors of cellular proliferation Warner-Lambert Company LLC (US) 2007-07-11 EP disclosed
US-20040224958-A1 Pyridopyrimidinone derivatives for treatment of neurodegenerative disease BOOTH RICHARD JOHN (US) 2004-11-11 US disclosed
US-6498163-B1 POTENT INHIBITORS OF CYCLIN-DEPENDENT KINASES AND GROWTH FACTOR MEDIATED KINASES; CANCER, RESTENOSIS, ATHEROSCLEROSIS WARNER-LAMBERT COMPANY 2002-12-24 US disclosed
EP-0964864-A2 PYRIDO 2,3-D] PYRIMIDINES AND 4-AMINOPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-12-22 EP disclosed
WO-1998033798-A2 PYRIDO[2,3-D]PYRIMIDINES AND 4-AMINO-PYRIMIDINES AS INHIBITORS OF CELL PROLIFERATION WARNER LAMBERT COMPANY (US) 1998-08-06 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 CDK4 1/4885CCND1 23/4885CCND2 25/4885

“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.