SCHEMBL6073874

SCHEMBL6073874

CC(=O)N1CCN(c2ccc(Nc3ncc4ccc(N)nc4n3)cc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.64
SYK P43405 17/20 0.63
CDK4 P11802 2/20 0.58
CCND1 P24385 2/20 0.58
CCNE1 P24864 2/20 0.58
CDK2 P24941 2/20 0.58

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
SCHEMBL7501284 0.90 SYK (0.51) ALKSYKCDK4CCND1CCNE1
SCHEMBL6074010 0.86 CDK2 (0.59) ALKSYKCDK4CCND1CCNE1
SCHEMBL3971261 0.82 SYK (0.62) ALKSYKCDK4CCND1CCNE1
SCHEMBL6073852 0.81 CDK4 (0.55) SYKCDK4CCND1CCNE1CDK2
SCHEMBL3973604 0.81 SYK (0.58) ALKSYKCDK4CCND1CCNE1
SCHEMBL6074378 0.81 SYK (0.56) ALKSYKCDK4CCND1CCNE1
SCHEMBL6074063 0.81 SYK (0.56) ALKSYKCDK4CCND1CCNE1
SCHEMBL6073406 0.79 ALK (0.54) ALKSYKCDK4CCND1CCNE1
SCHEMBL29372589 0.79 ALK (0.67) ALKSYKCDK4CCND1CCNE1
SCHEMBL29575961 0.79 ALK (0.64) ALKSYKCDK4CCND1CCNE1

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 2 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 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 ALK 457/4885SYK 1176/4885CDK4 19/4885

“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.