SCHEMBL7302158

SCHEMBL7302158

COC(=O)c1ccccc1-c1oc(Br)c2cc(C)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 4/20 0.46
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 1/20 0.42
SLC6A4 P31645 3/20 0.42
NR4A2 P43354 2/20 0.42
SLC6A2 P23975 1/20 0.42
MAPT P10636 2/20 0.42
HSP90AA1 P07900 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 2/20 0.40
TP53 P04637 1/20 0.40
ABCB1 P08183 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
CYP46A1 Q9Y6A2 1/20 0.39
USP2 O75604 1/20 0.39
CFTR P13569 1/20 0.39
PAX8 Q06710 1/20 0.39

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
SCHEMBL9309854 0.88 TSHR (0.47) KMT2AKDM4EALDH1A1MAPTNPSR1
SCHEMBL7302856 0.87 AR (0.38) SLC6A3HTTKMT2AKDM4EALDH1A1
SCHEMBL7312950 0.86 KDM4E (0.53) HTTKMT2AKDM4EALDH1A1MAPT
SCHEMBL9318636 0.85 SLC6A3 (0.47) SLC6A3HTTKMT2AKDM4EALDH1A1
SCHEMBL8544448 0.84 KMT2A (0.46) SLC6A3HTTKMT2AKDM4EALDH1A1
SCHEMBL7302152 0.84 KDM4E (0.46) SLC6A3HTTKMT2AKDM4EALDH1A1
SCHEMBL27350253 0.83 KMT2A (0.45) SLC6A3HTTKMT2AKDM4EALDH1A1
SCHEMBL27350254 0.83 SLC6A3 (0.42) SLC6A3HTTKMT2AKDM4EALDH1A1
SCHEMBL9318400 0.81 BDKRB1 (0.41)
SCHEMBL9318622 0.78 KDM4E (0.47) SLC6A3HTTKMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0514198-B1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LTD (GB) 1998-08-05 EP disclosed
US-5498722-A HYPOTENSIVES GLAXO GROUP (GB) 1996-03-12 US disclosed
US-5374646-A Treatment or prophylasix of hypertension and diseases associated with cognitive disorders GLAXO GROUP LIMITED (GB) 1994-12-20 US disclosed
US-5332831-A Angiotensin antagonist GLAXO GROUP LIMITED (GB) 1994-07-26 US disclosed
US-5310927-A Hypotensive agents; cognition activators; imidazolyl-2-aryl derivatives GLAXO GROUP LIMITED (GB) 1994-05-10 US disclosed
CN-1079223-A Benzofuran derivative GLAXO GROUP LTD (GB) 1993-12-08 CN disclosed
EP-0559724-A1 BENZOFURAN AND BENZTHIOPHENE DERIVATIVES GLAXO GROUP LIMITED (GB) 1993-09-15 EP disclosed
CN-1066654-A Benzofuran derivative GLAXO GROUP LTD (GB) 1992-12-02 CN disclosed
WO-1992020673-A1 ANTIHYPOTENSIVE BENZOFURAN DERIVATIVES WITH N-LINKED 1H-IMIDAZOLYLMETHYL-5-CARBOXAMIDE SUBSTITUENTS GLAXO GROUP LIMITED (GB) 1992-11-26 WO disclosed
WO-1992020674-A1 1H-IMIDAZOL-1-YL-METHYL BENZOFURAN DERIVATIVES, WITH THE IMIDAZOLYL MOIETY BEING SUBSTITUTED BY A CYCLOALKYL GROUP GLAXO GROUP LIMITED (GB) 1992-11-26 WO disclosed
EP-0514216-A1 Antihypotensive benzofuran derivatives with N-linked 1H-imidazolyl-methyl-5-carboxamide substituents GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed
EP-0514193-A1 N-linked imidazolyl-methyl benzofuran derivatives with antihypotensive activity GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed
EP-0514198-A1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed
WO-1992009600-A1 BENZOFURAN AND BENZTHIOPHENE DERIVATIVES GLAXO GROUP LIMITED (GB) 1992-06-11 WO disclosed
CN-1052672-A Benzofuran derivative GLAXO GROUP LTD (GB) 1991-07-03 CN disclosed
EP-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP disclosed