SCHEMBL31489380

SCHEMBL31489380

C[C@H](c1ccc(F)cc1)n1cc(-c2cncc(Br)n2)cn1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 9/20 0.40
CCNT1 O60563 1/20 0.37
CDK9 P50750 1/20 0.37
CYP17A1 P05093 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
MET P08581 4/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
RIPK1 Q13546 1/20 0.34
CLK1 P49759 1/20 0.32
DYRK1A Q13627 1/20 0.32

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
SCHEMBL31489470 1.00 CREBBP (0.40) CREBBPCCNT1CDK9CYP17A1GPR55
SCHEMBL31489258 0.85 CREBBP (0.42) CREBBPCYP17A1GPR55RIPK1
SCHEMBL31489347 0.85 CREBBP (0.42) CREBBPCYP17A1GPR55RIPK1
SCHEMBL31489819 0.84 CYP17A1 (0.40) CCNT1CDK9CYP17A1JAK2JAK1
SCHEMBL31489438 0.84 CYP17A1 (0.40) CCNT1CDK9CYP17A1JAK2JAK1
SCHEMBL31489474 0.79 CREBBP (0.46) CREBBPCYP17A1GPR55JAK2JAK1
SCHEMBL31489417 0.79 CREBBP (0.46) CREBBPCYP17A1GPR55JAK2JAK1
SCHEMBL31489770 0.77 CREBBP (0.39) CREBBPCYP17A1GPR55METJAK2
SCHEMBL31489699 0.77 CREBBP (0.39) CREBBPCYP17A1GPR55METJAK2
SCHEMBL31489790 0.75 CREBBP (0.45) CREBBPCYP17A1GPR55JAK2JAK1

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