SCHEMBL10503243

SCHEMBL10503243

CCCCCCCC(Cc1ccc(OC(C)=O)c(OC)c1)C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.56
PTGS1 P23219 1/20 0.48
EPHX2 P34913 1/20 0.47
LDHA P00338 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
ALOX15 P16050 1/20 0.46
SIGMAR1 Q99720 3/20 0.46

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
SCHEMBL30568773 0.93 LDHA (0.54) LTA4HEPHX2LDHASIGMAR1
SCHEMBL29549524 0.93 LDHA (0.54) LTA4HEPHX2LDHASIGMAR1
SCHEMBL29549313 0.92 LDHA (0.55) LTA4HEPHX2LDHAALOX15SIGMAR1
SCHEMBL29370506 0.85 HTR1A (0.59) LTA4HTRPV1ALOX15
SCHEMBL299310 0.85 HTR1A (0.59) LTA4HTRPV1ALOX15
SCHEMBL1286871 0.85 HTR1A (0.59) LTA4HTRPV1ALOX15
SCHEMBL28162513 0.85 HTR1A (0.59) LTA4HTRPV1ALOX15
SCHEMBL29549298 0.85 HTR1A (0.59) LTA4HTRPV1ALOX15
SCHEMBL3393167 0.85 HTR1A (0.59) LTA4HTRPV1ALOX15
SCHEMBL28516417 0.84 HTR1A (0.58) LTA4HTRPV1ALOX15

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-0149544-B1 PHARMACEUTICAL PRODUCTS PROVIDING ENHANCED ANALGESIA THE PROCTER & GAMBLE COMPANY (US) 1989-09-13 EP disclosed
EP-0149544-A2 Pharmaceutical products providing enhanced analgesia THE PROCTER & GAMBLE COMPANY (US) 1985-07-24 EP disclosed