SCHEMBL31376969

SCHEMBL31376969

CCc1ccc(CC2SC(=O)N(CCCC(=O)O)C2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.50
MCL1 Q07820 1/20 0.47
POLB P06746 1/20 0.43
ALDH1A1 P00352 5/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
GAA P10253 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 3/20 0.38
LMNA P02545 2/20 0.38
HPGD P15428 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GLA P06280 1/20 0.38
ALOX12 P18054 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.36
MITF O75030 1/20 0.36
XBP1 P17861 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL31376924 0.79 ALDH1A1 (0.46) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL31376936 0.79 KMT2A (0.51) POLBALDH1A1MEN1KMT2AGAA
SCHEMBL31376952 0.78 ALDH1A1 (0.46) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL31376938 0.78 ALDH1A1 (0.43) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL31377015 0.78 ALDH1A1 (0.45) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL31376957 0.78 PTPN12 (0.48) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL31376958 0.78 ALDH1A1 (0.43) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL31377008 0.78 ALDH1A1 (0.43) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL31376974 0.76 POLB (0.41) PPARGMCL1POLBALDH1A1MEN1
SCHEMBL12008491 0.75 GAA (0.39) PPARGMCL1POLBALDH1A1MEN1

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-2025064325-A1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES, INC. (US) 2025-03-27 WO disclosed