SCHEMBL11219683

SCHEMBL11219683

O=C(O)/C=C/Cc1ccc(-c2ccc(C/C=C/C(=O)O)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR2 Q9HBW0 1/20 0.42
LPAR3 Q9UBY5 1/20 0.42
LMNA P02545 4/20 0.42
TSHR P16473 2/20 0.42
ABCC4 O15439 1/20 0.42
GAA P10253 1/20 0.42
PTGS1 P23219 1/20 0.42
HTT P42858 1/20 0.42
MAOB P27338 1/20 0.41
FFAR1 O14842 1/20 0.39
GABRR1 P24046 2/20 0.39
GABRR2 P28476 2/20 0.39
BLM P54132 2/20 0.39
GABRR3 A8MPY1 1/20 0.39
APEX1 P27695 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL11219685 1.00 LPAR2 (0.42) LPAR2LPAR3LMNATSHRABCC4
SCHEMBL7364003 0.94 LMNA (0.52) LMNATSHRABCC4GAAPTGS1
SCHEMBL11366685 0.93 MAOB (0.46) LMNATSHRMAOBGABRR1GABRR2
SCHEMBL3119857 0.85 CA2 (0.50) GAAMAOBALDH1A1MAPTCA1
SCHEMBL1160962 0.85 CA2 (0.50) GAAMAOBALDH1A1MAPTCA1
SCHEMBL1160961 0.85 CA2 (0.50) GAAMAOBALDH1A1MAPTCA1
SCHEMBL1233515 0.84 MAOB (0.61) LMNAMAOBALDH1A1GPR52TOP1
SCHEMBL2280548 0.84 MAOB (0.61) LMNAMAOBALDH1A1GPR52TOP1
SCHEMBL2555173 0.84 MAOB (0.61) LMNAMAOBALDH1A1GPR52TOP1
SCHEMBL9696619 0.83 ALDH1A1 (0.50) MAOBTDP1ALDH1A1

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
US-4366171-A Fungicidal biphenyl esters, mixtures thereof and method of use GAF CORPORATION (US) 1982-12-28 US disclosed