SCHEMBL7314778

SCHEMBL7314778

O=C(OCc1ccccc1)c1ccccc1-c1oc(Br)c2cc(CBr)ccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.46
ALDH1A1 P00352 5/20 0.44
TDP1 Q9NUW8 4/20 0.43
AKR1B1 P15121 1/20 0.40
L3MBTL1 Q9Y468 5/20 0.39
CYP3A4 P08684 2/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 3/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
POLB P06746 2/20 0.39
KMT2A Q03164 3/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
NPC1 O15118 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 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
SCHEMBL9313945 0.88 CYP4F2 (0.48) TSHRALDH1A1CYP3A4RAB9AKMT2A
SCHEMBL7303042 0.87 NPC1 (0.47) TSHRALDH1A1TDP1AKR1B1L3MBTL1
SCHEMBL7314770 0.86 TSHR (0.45) TSHRALDH1A1TDP1AKR1B1L3MBTL1
SCHEMBL8544448 0.85 KMT2A (0.46) TSHRALDH1A1RAB9AKMT2ASLC6A2
SCHEMBL9710721 0.85 ALDH1A1 (0.47) TSHRALDH1A1TDP1RAB9AKMT2A
SCHEMBL7303338 0.83 AR (0.34) ALDH1A1RAB9AKMT2ASLC6A3NPC1
SCHEMBL9309854 0.75 TSHR (0.47) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL9178840 0.75 ALDH1A1 (0.56) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL9313939 0.74 ALOX5 (0.50) TSHRALDH1A1L3MBTL1KMT2AMEN1
SCHEMBL9320112 0.73 SLC6A3 (0.43) ALDH1A1RAB9AKMT2ASLC6A2SLC6A3

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
US-5310927-A Hypotensive agents; cognition activators; imidazolyl-2-aryl derivatives GLAXO GROUP LIMITED (GB) 1994-05-10 US disclosed
EP-0514193-A1 N-linked imidazolyl-methyl benzofuran derivatives with antihypotensive activity GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed
WO-1992016552-A1 1-IMIDAZOLGEMETHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF ANGIOTENSIN II ACTIVITY GLAXO GROUP LIMITED (GB) 1992-10-01 WO disclosed
EP-0505954-A1 N-Imidazolylmethyl benzofuran derivatives as inhibitors of angiotensin II activity GLAXO GROUP LIMITED (GB) 1992-09-30 EP disclosed