SCHEMBL10497432

SCHEMBL10497432

CCCCCCCCCCCCCCCCCCCCCc1ccc(C(=S)C=Cc2cccc(OCCCCC)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 1/20 0.52
▸ TLR4 O00206 1/20 0.46
▸ TLR2 O60603 1/20 0.46
▸ PLA2G4B P0C869 1/20 0.45
▸ SMPD1 P17405 4/20 0.45
▸ PPARA Q07869 4/20 0.43
▸ PPARG P37231 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL10499064 0.98 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9338411 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9342737 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9338292 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9339752 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9338557 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9342494 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9337348 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9337916 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1
SCHEMBL9342093 0.96 CYSLTR2 (0.52) CYSLTR2TLR4TLR2PLA2G4BSMPD1

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
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
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