SCHEMBL31489591

SCHEMBL31489591

CC(c1ccc(F)cc1)n1cc(I)cn1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 8/20 0.39
CYP17A1 P05093 1/20 0.39
GPR55 Q9Y2T6 4/20 0.37
MET P08581 3/20 0.33
CLK1 P49759 1/20 0.33
DYRK1A Q13627 1/20 0.33
RIPK1 Q13546 3/20 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
SCHEMBL31489224 1.00 CREBBP (0.39) CREBBPCYP17A1GPR55METCLK1
SCHEMBL31489764 0.83 CREBBP (0.51) CREBBP
SCHEMBL31489905 0.83 CREBBP (0.51) CREBBP
SCHEMBL31489456 0.83 PDE2A (0.37) CREBBP
SCHEMBL31489672 0.83 PDE2A (0.37) CREBBP
SCHEMBL24783582 0.81 CYP17A1 (0.43) CREBBPCYP17A1GPR55METCLK1
SCHEMBL31489479 0.81 CREBBP (0.52) CREBBPDYRK1A
SCHEMBL31489752 0.81 CREBBP (0.52) CREBBPDYRK1A
SCHEMBL24783581 0.81 CYP17A1 (0.43) CREBBPCYP17A1GPR55METCLK1
SCHEMBL26509021 0.81 CYP17A1 (0.43) CREBBPCYP17A1GPR55METCLK1

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