SCHEMBL20123124

SCHEMBL20123124

Bc1ccccc1-c1cccc2c1oc1ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.57
PRKDC P78527 5/20 0.45
PIK3CD O00329 1/20 0.44
PIK3CB P42338 1/20 0.44
GGPS1 O95749 1/20 0.40
ATM Q13315 1/20 0.40
AHR P35869 3/20 0.40
MAOA P21397 3/20 0.39
HDAC8 Q9BY41 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PTGES2 Q9H7Z7 1/20 0.37
CYP2C19 P33261 1/20 0.37
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GLA P06280 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL21659052 0.91 ALOX5 (0.55) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL10945864 0.88 ALOX5 (0.68) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL16633881 0.86 ALOX5 (0.67) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL5028273 0.86 ALOX5 (0.66) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL12996513 0.86 ALOX5 (0.66) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL430138 0.86 ALOX5 (0.66) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL431458 0.86 ALOX5 (0.66) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL17974232 0.84 ALOX5 (0.69) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL470697 0.84 ALOX5 (0.46) ALOX5AHRMAOAMEN1KMT2A
SCHEMBL22821366 0.80 ALOX5 (0.51) ALOX5PRKDCPIK3CDPIK3CBGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3033405-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-05-09 EP disclosed