SCHEMBL31633596

SCHEMBL31633596

CC/C=C\CCC(=O)O.CC/C=C\CCC=O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.70
CYP19A1 P11511 4/20 0.70
MAPT P10636 4/20 0.70
PPARG P37231 3/20 0.70
OXER1 Q8TDS5 3/20 0.70
RXRA P19793 2/20 0.70
FFAR1 O14842 2/20 0.70
PTGS1 P23219 4/20 0.55
F7 P08709 3/20 0.55
F3 P13726 3/20 0.55
PPARA Q07869 3/20 0.55
KMT2A Q03164 2/20 0.55
PPARD Q03181 2/20 0.55
ADORA3 P0DMS8 1/20 0.55
LMNA P02545 2/20 0.52
ALOX15 P16050 2/20 0.52
RECQL P46063 2/20 0.52
BLM P54132 2/20 0.52
HSD17B10 Q99714 2/20 0.52
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL113370 0.89
SCHEMBL113369 0.89
SCHEMBL841086 0.89
SCHEMBL11225745 0.89 PPARG (0.52) ALDH1A1CYP19A1MAPTPPARGOXER1
SCHEMBL11225743 0.89 PPARG (0.52) ALDH1A1CYP19A1MAPTPPARGOXER1
SCHEMBL7750399 0.89 PPARG (0.52) ALDH1A1CYP19A1MAPTPPARGOXER1
SCHEMBL7756223 0.89 PPARG (0.52) ALDH1A1CYP19A1MAPTPPARGOXER1
SCHEMBL7750390 0.89 PPARG (0.52) ALDH1A1CYP19A1MAPTPPARGOXER1
SCHEMBL116898 0.85 ALDH1A1 (0.96) ALDH1A1CYP19A1MAPTPPARGOXER1
SCHEMBL117314 0.85 ALDH1A1 (0.96) ALDH1A1CYP19A1MAPTPPARGOXER1

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
CN-120192890-A Pediococcus acidilactici and fermented food prepared from same 海南省农业科学院农产品加工设计研究所 2025-06-24 CN disclosed