SCHEMBL7899189

SCHEMBL7899189

CCOC(=O)CCc1cc(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.51
GRM6 O15303 1/20 0.47
EP300 Q09472 2/20 0.45
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.44
HPGD P15428 4/20 0.44
KDM4E B2RXH2 3/20 0.44
RAB9A P51151 2/20 0.44
TP53 P04637 2/20 0.44
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
CASP3 P42574 1/20 0.44
KMT2A Q03164 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
GAA P10253 2/20 0.41

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
SCHEMBL7760695 0.85 OPRD1 (0.56) OPRD1EP300ALDH1A1MAPTHPGD
SCHEMBL7756777 0.84 OPRD1 (0.52) OPRD1GRM6EP300ALDH1A1KDM4E
SCHEMBL7902764 0.84 OPRD1 (0.54) OPRD1GRM6EP300ALDH1A1MAPT
SCHEMBL7760704 0.83 OPRD1 (0.49) OPRD1GRM6EP300ALDH1A1MAPT
SCHEMBL7761536 0.82 OPRD1 (0.48) OPRD1GRM6EP300ALDH1A1MAPT
SCHEMBL678077 0.80 ALOX5 (0.56) OPRD1GRM6EP300ALDH1A1KDM4E
SCHEMBL7756786 0.79 OPRD1 (0.47) OPRD1EP300MAPK14
SCHEMBL5599629 0.77 OPRD1 (0.53) OPRD1EP300ALDH1A1MAPTHPGD
SCHEMBL7760717 0.76 OPRD1 (0.50) OPRD1EP300KDM4EMEN1KMT2A
SCHEMBL7760707 0.76 OPRD1 (0.50) OPRD1EP300KDM4EMEN1KMT2A

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
US-RE37078-E1 Thiophene compounds ADIR ET COMPAGNIE (FR) 2001-02-27 US disclosed
US-5705525-A ANTIINFLAMMATORY AGENTS AND TREATMENT OF RHEUMATIC DISEASES ADIR ET COMPAGNIE (FR) 1998-01-06 US disclosed