SCHEMBL31489197

SCHEMBL31489197

CC[C@H](c1ccc(F)cc1)n1cc(-c2cccc(B3OC(C)(C)C(C)(C)O3)c2F)cn1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
TYK2 P29597 1/20 0.33
JAK3 P52333 1/20 0.33
CYP17A1 P05093 1/20 0.33
PDK2 Q15119 1/20 0.31
CXCR2 P25025 2/20 0.31

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
SCHEMBL31489496 1.00 LPL (0.33) LPLLIPGJAK2JAK1TYK2
SCHEMBL31489593 0.87 CREBBP (0.41) LPLLIPGPDK2
SCHEMBL31489264 0.87 CREBBP (0.41) LPLLIPGPDK2
SCHEMBL31489237 0.83 PDK2 (0.34) LPLLIPGPDK2CXCR2
SCHEMBL31489863 0.83 PDK2 (0.34) LPLLIPGPDK2CXCR2
SCHEMBL31489590 0.79 CYP17A1 (0.38) JAK2JAK1TYK2JAK3CYP17A1
SCHEMBL31489746 0.79 CYP17A1 (0.38) JAK2JAK1TYK2JAK3CYP17A1
SCHEMBL22585809 0.79 LPL (0.43) LPLLIPGJAK2JAK1TYK2
SCHEMBL31489271 0.79 LPL (0.43) LPLLIPGJAK2JAK1TYK2
SCHEMBL31489712 0.79 LPL (0.43) LPLLIPGJAK2JAK1TYK2

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