SCHEMBL9508225

SCHEMBL9508225

CCCCCCCCCOCC(O)CN(CCS(=O)(=O)O)C(=O)CCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPAR5 Q9H1C0 1/20 0.45
USP2 O75604 1/20 0.44
HTT P42858 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
PLA2G2C Q5R387 6/20 0.39
SPHK1 Q9NYA1 1/20 0.38
TLR2 O60603 2/20 0.37
P2RY10 O00398 1/20 0.36
LPAR1 Q92633 2/20 0.36
LPAR3 Q9UBY5 2/20 0.36
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL9506931 0.88 PLA2G2C (0.38) LPAR5USP2HTTCYP1A2CYP3A4
SCHEMBL2502289 0.86 FFAR4 (0.46) FFAR4
SCHEMBL7784431 0.86 FFAR4 (0.46) FFAR4
SCHEMBL2493471 0.85 LPAR5 (0.47) LPAR5USP2HTTCYP1A2CYP3A4
SCHEMBL9417254 0.85 USP2 (0.53) LPAR5USP2HTTCYP1A2CYP3A4
SCHEMBL5180698 0.85 USP2 (0.53) LPAR5USP2HTTCYP1A2CYP3A4
SCHEMBL10601287 0.85 USP2 (0.53) LPAR5USP2HTTCYP1A2CYP3A4
SCHEMBL5178380 0.85 USP2 (0.53) LPAR5USP2HTTCYP1A2CYP3A4
SCHEMBL5604280 0.85 USP2 (0.53) LPAR5USP2HTTCYP1A2CYP3A4
SCHEMBL5180047 0.85 USP2 (0.53) LPAR5USP2HTTCYP1A2CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555250-A1 COSMETIC COMPOSITION UNILEVER PLC (GB) 1993-08-18 EP disclosed
WO-1992006982-A1 COSMETIC COMPOSITION UNILEVER PLC (GB) 1992-04-30 WO disclosed