SCHEMBL7489384

SCHEMBL7489384

O=Cc1cc(-c2cccnc2)cc2ccoc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.61
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CYP19A1 P11511 4/20 0.43
CYP3A4 P08684 3/20 0.43
CYP2A6 P11509 3/20 0.43
CYP11B1 P15538 3/20 0.43
CYP11B2 P19099 3/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP17A1 P05093 1/20 0.43
CYP2E1 P05181 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2B6 P20813 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2D6 P10635 1/20 0.42
EGFR P00533 1/20 0.40
PDGFRB P09619 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
SCHEMBL7480988 0.82 ERN1 (0.44) ERN1KDM4ENPC1RAB9ACYP2A6
SCHEMBL7493962 0.81 ERN1 (0.42) ERN1NPC1RAB9ACYP2A6PIM1
SCHEMBL7493466 0.77 ERN1 (0.36) ERN1CYP2A6
SCHEMBL7485876 0.76 ERN1 (0.40) ERN1
SCHEMBL7491658 0.76 ERN1 (0.48) ERN1PIM1PIM2
SCHEMBL6644954 0.76 ERN1 (1.00) ERN1CYP19A1CYP11B1CYP11B2
SCHEMBL29396037 0.76 ERN1 (1.00) ERN1CYP19A1CYP11B1CYP11B2
SCHEMBL7488546 0.75 HPGDS (0.39) ERN1CYP2A6
SCHEMBL14620688 0.75 ERN1 (0.41) ERN1L3MBTL1KDM4ENPC1RAB9A
SCHEMBL5155905 0.75 ESR1 (0.49) ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783499-B1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LTD (GB) 2002-10-23 EP disclosed
US-5935972-A Benzofuran derivatives as tachykinin antagonists GLAXO GROUP LIMITED (GB) 1999-08-10 US disclosed
EP-0783499-A1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LIMITED (GB) 1997-07-16 EP disclosed
WO-1995006645-A1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LIMITED (GB) 1995-03-09 WO disclosed