SCHEMBL31704088

SCHEMBL31704088

Cc1sc(-c2ccc(C(F)(F)F)cc2)nc1C(=O)NCc1cccc[n+]1[O-]

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 11/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ PPARD Q03181 4/20 0.44
▸ MAPT P10636 1/20 0.43
▸ PPARG P37231 5/20 0.42
▸ TACR1 P25103 1/20 0.41
▸ CHRM4 P08173 1/20 0.41
▸ FFAR1 O14842 2/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL31703765 0.89 PPARA (0.42) PPARANPC1ALDH1A1GAAPPARD
SCHEMBL31703795 0.84 CTSA (0.38) NPC1MAPTTACR1TP53
SCHEMBL31703869 0.83 TP53 (0.39) NPC1MAPTTP53
SCHEMBL31703870 0.83 TP53 (0.39) NPC1MAPTTP53
SCHEMBL31703796 0.80 TLR7 (0.59) ALDH1A1MAPTTP53
SCHEMBL31703902 0.79 APOBEC3A (0.36) PPARAALDH1A1GAAPPARDMAPT
SCHEMBL31704036 0.77 HDAC3 (0.42) ALDH1A1GAAMAPTTP53
SCHEMBL26617246 0.74 EPHX2 (0.51) TACR1TP53
SCHEMBL31704004 0.74 NPSR1 (0.51) ALDH1A1GAAMAPTTACR1TP53
SCHEMBL18003992 0.73 MAPT (0.54) PPARANPC1ALDH1A1GAAPPARD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025215450-A1 THIAZOLE COMPOUNDS AS SODIUM CHANNEL BLOCKERS SK BIOPHARMACEUTICALS CO., LTD. (KR) 2025-10-16 — — WO claimed
WO-2025215450-A1 THIAZOLE COMPOUNDS AS SODIUM CHANNEL BLOCKERS SK BIOPHARMACEUTICALS CO., LTD. (KR) 2025-10-16 — — WO disclosed
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