SCHEMBL6073777

SCHEMBL6073777

CC(O)NC(=O)Nc1ccc2cnc(Nc3ccncc3)nc2n1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.43
CDK4 P11802 1/20 0.40
CCND1 P24385 1/20 0.40
CCND2 P30279 1/20 0.40
CCND3 P30281 1/20 0.40
CSNK1A1 P48729 1/20 0.39
MAPK1 P28482 2/20 0.38
PIK3CA P42336 2/20 0.38
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37

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
SCHEMBL6073611 0.83 CDK4 (0.41) BRAFCDK4CCND1CCND2CCND3
SCHEMBL6074500 0.83 PIK3CA (0.55) MAPK1PIK3CAMAPK8MAPK9MAPK10
SCHEMBL3971186 0.80 BRAF (0.43) BRAFCDK4CCND1CCND2CCND3
SCHEMBL6073788 0.80 PIK3CA (0.42) BRAFCDK4CCND1CCND2CCND3
SCHEMBL6073553 0.78 EPHX1 (0.56)
SCHEMBL6074527 0.73 CDK4 (0.55) CDK4CCND1CCND2CCND3MAPK8
SCHEMBL6073991 0.73 FGFR1 (0.44) CDK4CCND1CCND2CCND3CSNK1A1
SCHEMBL3967522 0.72 IKBKB (0.46) BRAFCDK4CCND1CCND2CCND3
SCHEMBL6073563 0.69 CDK4 (0.50) CDK4CCND1CCND2CCND3MAPK8
SCHEMBL4239474 0.69 CSNK1A1 (0.52) CDK4CCND1CCND2CCND3CSNK1A1

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
US-7053070-B2 Pyrido[2,3-d]pyrimidine-2,7-diamine kinase inhibitors WARNER-LAMBERT COMPANY (US) 2006-05-30 US claimed
US-20030073668-A1 Pyrido[2,3-d]pyrimidine-2,7-diamine kinase inhibitors BOOTH RICHARD JOHN (US) 2003-04-17 US claimed
US-7053070-B2 Pyrido[2,3-d]pyrimidine-2,7-diamine kinase inhibitors WARNER-LAMBERT COMPANY (US) 2006-05-30 US disclosed
US-20030073668-A1 Pyrido[2,3-d]pyrimidine-2,7-diamine kinase inhibitors BOOTH RICHARD JOHN (US) 2003-04-17 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-20030073668-A1 Pyrido[2,3-d]pyrimidine-2,7-diamine kinase inhibitors CDK9, CDK19, CDK3 BRAF 576/4885CDK4 19/4885CCND1 79/4885

“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.