SCHEMBL31489464

SCHEMBL31489464

CC1(C)OB(c2cnn(C(CCF)c3ccc(F)cc3)c2)OC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.42
LIPG Q9Y5X9 2/20 0.42
FFAR1 O14842 1/20 0.41
CYP19A1 P11511 2/20 0.35
ESR2 Q92731 1/20 0.33
CXCR2 P25025 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
SCHEMBL22585809 0.88 LPL (0.43) LPLLIPGFFAR1CYP19A1ESR2
SCHEMBL31489712 0.88 LPL (0.43) LPLLIPGFFAR1CYP19A1ESR2
SCHEMBL31489271 0.88 LPL (0.43) LPLLIPGFFAR1CYP19A1ESR2
SCHEMBL31489480 0.87 LPL (0.43) LPLLIPGFFAR1CYP19A1ESR2
SCHEMBL31489793 0.85 FFAR1 (0.43) LPLLIPGFFAR1CYP19A1ESR2
SCHEMBL31489511 0.82 LPL (0.47) LPLLIPGFFAR1ESR2CXCR2
SCHEMBL15653015 0.82 LPL (0.47) LPLLIPGFFAR1ESR2CXCR2
SCHEMBL22558697 0.80 LPL (0.44) LPLLIPGFFAR1ESR2CXCR2
SCHEMBL31489648 0.79 LPL (0.43) LPLLIPGFFAR1ESR2CXCR2
SCHEMBL31489362 0.79 LPL (0.43) LPLLIPGFFAR1ESR2CXCR2

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