SCHEMBL7760704

SCHEMBL7760704

CCN(O)C(=O)CCc1cc(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.49
EP300 Q09472 2/20 0.43
GRM6 O15303 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 5/20 0.38
RAB9A P51151 4/20 0.38
ALDH1A1 P00352 3/20 0.38
TP53 P04637 2/20 0.38
HSD17B10 Q99714 2/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 3/20 0.38
LMNA P02545 3/20 0.38
TSHR P16473 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 1/20 0.38
ALOX5 P09917 2/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 2/20 0.38
KMT2A Q03164 2/20 0.38
CASP3 P42574 1/20 0.38

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
SCHEMBL7756777 0.89 OPRD1 (0.52) OPRD1EP300GRM6TDP1KDM4E
SCHEMBL7761536 0.85 OPRD1 (0.48) OPRD1EP300GRM6KDM4ERAB9A
SCHEMBL7756786 0.84 OPRD1 (0.47) OPRD1EP300ALOX5
SCHEMBL7899189 0.83 OPRD1 (0.51) OPRD1EP300GRM6KDM4ERAB9A
SCHEMBL7760695 0.83 OPRD1 (0.56) OPRD1EP300KDM4EALDH1A1HSD17B10
SCHEMBL678077 0.82 ALOX5 (0.56) OPRD1EP300GRM6KDM4ERAB9A
SCHEMBL7902764 0.82 OPRD1 (0.54) OPRD1EP300GRM6TDP1KDM4E
SCHEMBL14195275 0.78 ALOX5 (0.51) OPRD1EP300ALOX5
SCHEMBL5599629 0.75 OPRD1 (0.53) OPRD1EP300KDM4ERAB9AALDH1A1
SCHEMBL8689165 0.74 OPRD1 (0.49) OPRD1EP300GRM6TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0728755-B1 Thiophene compounds, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-04-11 EP claimed
US-RE37078-E1 Thiophene compounds ADIR ET COMPAGNIE (FR) 2001-02-27 US claimed
EP-0728755-A1 Thiophene compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-08-28 EP claimed