SCHEMBL31489659

SCHEMBL31489659

CC(F)(F)C(c1ccc(F)cc1)n1cccn1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.36
EGLN1 Q9GZT9 2/20 0.35
CYP19A1 P11511 6/20 0.35
CYP17A1 P05093 4/20 0.34
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CCNE2 O96020 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
PDE4B Q07343 1/20 0.30

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
SCHEMBL28331534 0.77 CYP17A1 (0.47) EGLN1CYP19A1CYP17A1MAPTMAPK1
SCHEMBL31489212 0.76 CYP26A1 (0.34) CYP26A1CYP19A1CYP17A1
SCHEMBL31489550 0.73 CYP26A1 (0.30) CYP26A1
SCHEMBL31489649 0.73 CYP26A1 (0.30) CYP26A1
SCHEMBL31489410 0.73 CYP26A1 (0.30) CYP26A1
SCHEMBL1243127 0.73 KCNA5 (0.50) CYP19A1HTTNPSR1
SCHEMBL3435309 0.70
SCHEMBL31489301 0.70 CYP26A1 (0.30) CYP26A1
SCHEMBL31489284 0.69 NPC1 (0.32)
SCHEMBL31489944 0.69 NPC1 (0.32)

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