SCHEMBL9318622

SCHEMBL9318622

COC(=O)c1ccccc1-c1oc2ccc(C)cc2c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.47
POLB P06746 2/20 0.47
SLC6A4 P31645 3/20 0.47
SLC6A3 Q01959 3/20 0.47
TP53 P04637 3/20 0.45
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
RXFP1 Q9HBX9 1/20 0.44
MAPT P10636 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALOX5 P09917 1/20 0.42
SLC6A2 P23975 1/20 0.42
NR4A2 P43354 1/20 0.42
HSP90AA1 P07900 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL12433181 0.87 SLC6A3 (0.51) KDM4ESLC6A4SLC6A3NPC1RAB9A
SCHEMBL9318354 0.87 KDM4E (0.45) KDM4EPOLBTP53NPC1RAB9A
SCHEMBL7302152 0.86 KDM4E (0.46) KDM4EPOLBSLC6A4SLC6A3TP53
SCHEMBL8544320 0.86 KDM4E (0.63) KDM4EPOLBTP53NPC1RAB9A
SCHEMBL9320103 0.83 SLC6A3 (0.43) KDM4ESLC6A4SLC6A3NPC1RAB9A
SCHEMBL9318636 0.82 SLC6A3 (0.47) KDM4EPOLBSLC6A4SLC6A3TP53
SCHEMBL9434971 0.80 KDM4E (0.47) KDM4EPOLBTP53NPC1RAB9A
SCHEMBL7302158 0.78 SLC6A3 (0.46) KDM4EPOLBSLC6A4SLC6A3TP53
SCHEMBL9309848 0.75 ALOX5 (0.53) KDM4EPOLBNPC1RAB9ARXFP1
SCHEMBL9571330 0.75 CYP4F2 (0.53) KDM4EMEN1KMT2AALDH1A1HPGD

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
US-5317023-A 2-Phenyl-(imidazo(4,5-b)pyridyl-methyl-) derivatives; hypertensive agents; cognition activators GLAXO GROUP LIMITED (GB) 1994-05-31 US disclosed
WO-1992020679-A1 BENZOFURAN DERIVATIVES GLAXO GROUP LIMITED (GB) 1992-11-26 WO disclosed
EP-0514197-A1 Anti-hypertensive benzofuran derivatives substituted by N-imidazolyl-methyl groups which are condensed with optionally nitrogen containing, six-membered rings GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed