SCHEMBL31661345

SCHEMBL31661345

CCCc1sc(N)nc1C(=O)OCC

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 2/20 0.72
ALDH1A1 P00352 6/20 0.65
CYP1A2 P05177 1/20 0.65
HPGD P15428 2/20 0.49
LMNA P02545 1/20 0.46
MAPT P10636 3/20 0.45
GAA P10253 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HSP90AA1 P07900 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
FHIT P49789 1/20 0.41
COPS5 Q92905 2/20 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
SCHEMBL31661235 0.87 ALDH1A1 (0.69) FBP1ALDH1A1CYP1A2HPGDLMNA
SCHEMBL28733822 0.87 ALDH1A1 (0.60) FBP1ALDH1A1CYP1A2HPGDLMNA
SCHEMBL3095838 0.86 FBP1 (0.66) FBP1ALDH1A1CYP1A2HPGDGAA
SCHEMBL594323 0.85 ALDH1A1 (0.58) FBP1ALDH1A1CYP1A2HPGDLMNA
SCHEMBL29235553 0.85 FBP1 (0.59) FBP1ALDH1A1CYP1A2HPGDLMNA
SCHEMBL4130111 0.84 FBP1 (1.00) FBP1ALDH1A1CYP1A2HPGDGAA
SCHEMBL31661321 0.81 FBP1 (0.50) FBP1ALDH1A1CYP1A2HPGDLMNA
SCHEMBL31661267 0.81 ALDH1A1 (0.60) FBP1ALDH1A1CYP1A2HPGDLMNA
SCHEMBL5217772 0.80 FBP1 (0.58) FBP1ALDH1A1CYP1A2MAPTGAA
SCHEMBL289441 0.80 ALDH1A1 (0.73) FBP1ALDH1A1CYP1A2HPGDLMNA

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-2025151402-A1 THIAZOLE TRPML1 AGONISTS AND USES THEREOF LIBRA THERAPEUTICS, INC. (US) 2025-07-17 WO disclosed