SCHEMBL6582668

SCHEMBL6582668

O=C(O)c1c(Br)nc(-c2ccccc2)n1Cc1cc2c(cc1Cl)OCO2

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 2/20 0.43
EDNRB P24530 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL6582630 0.87 MEN1 (0.40) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6577282 0.85 KDM4E (0.39) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6579996 0.83 HSP90AA1 (0.38) EDNRAKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6582508 0.78 EDNRA (0.43) EDNRAEDNRBALDH1A1
SCHEMBL6580208 0.77 EDNRB (0.45) EDNRAEDNRB
SCHEMBL6308654 0.76 EDNRB (0.55) EDNRAEDNRBALDH1A1
SCHEMBL8543285 0.75 EDNRB (0.69) EDNRAEDNRBALDH1A1
SCHEMBL6577691 0.73 MEN1 (0.43) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL17140162 0.73 ALDH1A1 (0.40) KDM4EALDH1A1HPGD
SCHEMBL8329557 0.73 MEN1 (0.39) EDNRAEDNRBKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804435-B1 NOVEL IMIDAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, NOVEL INTERMEDIATES THUS OBTAINED, MEDICINAL APPLICATIONS OF SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AVENTIS PHARMA SA (FR) 2004-03-10 EP claimed
US-5856509-A HYPOTENSIVE AGENTS ROUSSEL UCLAF (FR) 1999-01-05 US claimed
CN-1159805-A Nvel imidazole derivatives, method for preparing same, novel intermediates thus obtained, medicinal applications of same and pharmaceutical compositions containing same ROUSSEL UCLAF (FR) 1997-09-17 CN claimed
CN-1083838-C Nvel imidazole derivatives, method for preparing same, novel intermediates thus obtained, medicinal applications of same and pharmaceutical compositions containing same ROUSSEL UCLEF (FR) 2002-05-01 CN disclosed
US-5856509-A HYPOTENSIVE AGENTS ROUSSEL UCLAF (FR) 1999-01-05 US disclosed
CN-1159805-A Nvel imidazole derivatives, method for preparing same, novel intermediates thus obtained, medicinal applications of same and pharmaceutical compositions containing same ROUSSEL UCLAF (FR) 1997-09-17 CN disclosed