SCHEMBL31448615

SCHEMBL31448615

O=C(/C=C/c1ccc(/C=C/C(=O)c2ccccc2Cl)cc1)c1ccccc1Cl

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.73
PTGS2 P35354 2/20 0.73
MAOB P27338 5/20 0.65
MAOA P21397 4/20 0.65
CXCL12 P48061 1/20 0.62
MAPT P10636 5/20 0.59
ALDH1A1 P00352 2/20 0.59
TP53 P04637 2/20 0.59
KDM4E B2RXH2 2/20 0.59
MAPK1 P28482 2/20 0.59
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
CYP3A4 P08684 1/20 0.59
HPGD P15428 1/20 0.59
ALOX15 P16050 1/20 0.59
ALOX12 P18054 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
BCHE P06276 1/20 0.58
CYP2C19 P33261 1/20 0.58

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
SCHEMBL8987369 0.94 PTGS1 (0.67) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL8987373 0.94 PTGS1 (0.67) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL25234231 0.93 CYP3A4 (0.71) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL3611922 0.93 CYP3A4 (0.71) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL25223264 0.93 CYP3A4 (0.71) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL28913615 0.92 MAOB (0.69) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL26103962 0.92 PTGS1 (0.64) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL26104097 0.92 PTGS1 (0.64) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL25201291 0.90 PTGS1 (0.62) PTGS1PTGS2MAOBMAOACXCL12
SCHEMBL25194322 0.90 PTGS1 (0.62) PTGS1PTGS2MAOBMAOACXCL12

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-116444359-B Asymmetric double chalcone compound, synthesis method and application thereof 温州医科大学附属眼视光医院 2025-03-18 CN disclosed