SCHEMBL14520643

SCHEMBL14520643

CNC(=O)N1CC=C(c2cc3c(Nc4ccc(Cl)c(OC)c4)ccnc3[nH]2)CC1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 20/20 0.65
▸ CDK9 P50750 20/20 0.65

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
SCHEMBL14500606 0.91 CCNT1 (0.54) CCNT1CDK9
SCHEMBL5661862 0.90 CCNT1 (0.64) CCNT1CDK9
SCHEMBL5666489 0.88 CCNT1 (0.51) CCNT1CDK9
SCHEMBL14520468 0.88 CCNT1 (0.51) CCNT1CDK9
SCHEMBL5662444 0.88 CCNT1 (0.63) CCNT1CDK9
SCHEMBL5662923 0.87 CCNT1 (0.55) CCNT1CDK9
SCHEMBL5663004 0.86 CCNT1 (0.48) CCNT1CDK9
SCHEMBL5663001 0.86 CCNT1 (0.48) CCNT1CDK9
SCHEMBL5663027 0.83 CCNT1 (0.46) CCNT1CDK9
SCHEMBL14500292 0.82 CCNT1 (0.57) CCNT1CDK9

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
WO-2007067537-A1 PYRROLOPYRIDINE KINASE INHIBITING COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2007-06-14 — — WO disclosed
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