SCHEMBL31489660

SCHEMBL31489660

Cc1ccc(C)n1-c1nc2cc(-c3nc(-c4cnn(C(c5ccc(F)cc5)C5CC5)c4)ccc3F)ccn2n1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.35
NTRK1 P04629 2/20 0.33
CREBBP Q92793 1/20 0.33

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
SCHEMBL31489827 0.93 JAK2 (0.31) NTRK1
SCHEMBL31489722 0.90 NTRK1 (0.30) NTRK1
SCHEMBL31489769 0.88 BRD4 (0.36) BRD4NTRK1CREBBP
SCHEMBL31489702 0.86 NTRK1 (0.33) NTRK1
SCHEMBL31489494 0.86 NTRK1 (0.33) NTRK1
SCHEMBL31489381 0.86 PIK3CG (0.35) BRD4NTRK1CREBBP
SCHEMBL31489178 0.85
SCHEMBL31489483 0.83 NTRK1 (0.34) BRD4NTRK1CREBBP
SCHEMBL31489735 0.80 ROCK2 (0.31) NTRK1
SCHEMBL31489873 0.80 ROCK2 (0.31) NTRK1

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