SCHEMBL5900441

SCHEMBL5900441

CC(C)Nc1ncc2cc(C(C)c3ccccc3)c(=O)n(C3CCCC3)c2n1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCND1 P24385 16/20 0.54
CDK2 P24941 12/20 0.54
CDK4 P11802 11/20 0.54
CCNA2 P20248 3/20 0.54
CCNE1 P24864 9/20 0.50
CDK6 Q00534 7/20 0.50
CCND3 P30281 6/20 0.49
CCND2 P30279 5/20 0.49
MAPK8 P45983 1/20 0.48
MAPK9 P45984 1/20 0.48
MAPK10 P53779 1/20 0.48
MAPK14 Q16539 1/20 0.48
FGFR1 P11362 2/20 0.47
FGFR2 P21802 1/20 0.47
FGFR4 P22455 1/20 0.47
FGFR3 P22607 1/20 0.47
CCNT1 O60563 2/20 0.44
CDK9 P50750 2/20 0.44
CCNA1 P78396 1/20 0.43

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
SCHEMBL5900404 0.91 CCND1 (0.49) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900517 0.91 CCND1 (0.49) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900794 0.90 CDK2 (0.60) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900477 0.90 CCND1 (0.48) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900447 0.89 CDK2 (0.59) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900536 0.89 CCND1 (0.48) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900438 0.89 CCND1 (0.48) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900413 0.87 CCND1 (0.49) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900422 0.87 CCND1 (0.49) CCND1CDK2CDK4CCNA2CCNE1
SCHEMBL5900527 0.87 CDK2 (0.56) CCND1CDK2CDK4CCNA2CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060142312-A1 C6-aryl and heteroaryl substituted pyrido[2,3-D] pyrimidin-7-ones PFIZER INC 2006-06-29 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-20060142312-A1 C6-aryl and heteroaryl substituted pyrido[2,3-D] pyrimidin-7-ones CDK4, CDK2, CCNA1 CCND1 9/4885CDK2 2/4885CDK4 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.