SCHEMBL31489710

SCHEMBL31489710

[2H]C([2H])(O)C(c1ccc(F)cc1)n1cc(-c2cncc(-c3ccn4nc(-n5c(C)ccc5C)nc4c3)n2)cn1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 2/20 0.31
CDK9 P50750 2/20 0.31
CDK2 P24941 1/20 0.31
ROCK2 O75116 1/20 0.30

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
SCHEMBL31489408 1.00 CCNT1 (0.31) CCNT1CDK9CDK2ROCK2
SCHEMBL31489528 0.92 CCNT1 (0.31) CCNT1CDK9CDK2ROCK2
SCHEMBL31489522 0.90 JAK2 (0.33) CCNT1CDK9CDK2
SCHEMBL31489578 0.89 ROCK2 (0.31) ROCK2
SCHEMBL31489923 0.89 ROCK2 (0.30) ROCK2
SCHEMBL31489396 0.88
SCHEMBL31489743 0.86 PIK3CG (0.37)
SCHEMBL31489208 0.86 PIK3CG (0.37)
SCHEMBL31489395 0.85 NTRK1 (0.31) CCNT1CDK9
SCHEMBL31489829 0.85 CYP11B2 (0.31)

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-2025072395-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed