SCHEMBL5263269

SCHEMBL5263269

CC(C1CCCCC1)n1c(=O)ccc2cnc(Nc3ccc(-n4cccn4)cc3)nc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.52
CDK4 P11802 17/20 0.51
CCND1 P24385 17/20 0.51
CCND2 P30279 15/20 0.51
CCND3 P30281 15/20 0.51
CCNA2 P20248 9/20 0.51
CDK2 P24941 9/20 0.51
CCNE2 O96020 6/20 0.51
CCNE1 P24864 6/20 0.51
CCNA1 P78396 6/20 0.51
FGFR1 P11362 5/20 0.51
FGFR2 P21802 5/20 0.51
FGFR4 P22455 5/20 0.51
FGFR3 P22607 5/20 0.51
CCNB2 O95067 4/20 0.51
CDK1 P06493 4/20 0.51
CCNB1 P14635 4/20 0.51
CCNB3 Q8WWL7 4/20 0.51
SYK P43405 1/20 0.48
PAK4 O96013 1/20 0.47

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
SCHEMBL5263480 0.91 JAK3 (0.53) JAK3CDK4CCND1CCND2CCND3
SCHEMBL5266762 0.90 JAK3 (0.53) JAK3CDK4CCND1CCND2CCND3
SCHEMBL5263601 0.87 CDK4 (0.50) JAK3CDK4CCND1CCND2CCND3
SCHEMBL5264438 0.85 CDK4 (0.70) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5269621 0.84 CDK4 (0.68) CDK4CCND1CCND2CCND3CCNA2
SCHEMBL5263585 0.83 CDK4 (0.71) JAK3CDK4CCND1CCND2CCND3
SCHEMBL5262216 0.83 CDK4 (0.71) JAK3CDK4CCND1CCND2CCND3
SCHEMBL5267973 0.82 CDK4 (0.55) JAK3CDK4CCND1CCND2CCND3
SCHEMBL5269593 0.82 CDK4 (0.76) JAK3CDK4CCND1CCND2CCND3
SCHEMBL5267164 0.82 CDK4 (0.54) JAK3CDK4CCND1CCND2CCND3

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 JAK3 1282/4885CDK4 1/4885CCND1 23/4885

“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.