SCHEMBL2714039

SCHEMBL2714039

Oc1ccc(O)c(Oc2ccccc2)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.48
NR1H2 P55055 1/20 0.48
BAX Q07812 1/20 0.48
TSHR P16473 1/20 0.48
KDM4E B2RXH2 3/20 0.43
MAPT P10636 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 2/20 0.43
GPR55 Q9Y2T6 2/20 0.43
CNR1 P21554 1/20 0.43
GLA P06280 1/20 0.42
TTR P02766 2/20 0.40
HSD17B10 Q99714 1/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA12 O43570 1/20 0.39
CA7 P43166 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
MAOA P21397 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
SCHEMBL10931576 0.88 LTA4H (0.55) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL9789635 0.85 TTR (0.49) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL2864863 0.84 KDM4E (0.49) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL1834612 0.81 LTA4H (0.52) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL8720652 0.80 LTA4H (0.58) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL10412578 0.80 LTA4H (0.46) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL2856384 0.79 KDM4E (0.46) LTA4HNR1H2BAXKDM4EMAPT
SCHEMBL982234 0.78 TTR (0.50) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL2865457 0.78 KDM4E (0.51) LTA4HNR1H2BAXTSHRKDM4E
SCHEMBL28177362 0.78 LTA4H (0.55) LTA4HNR1H2BAXTSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2630204-A1 QUINONE COMPOUNDS FOR USE IN PHOTOVOLTAICS Rhodia Operations (FR) 2013-08-28 EP disclosed
WO-2012052188-A1 QUINONE COMPOUNDS FOR USE IN PHOTOVOLTAICS RHODIA OPERATIONS (FR) 2012-04-26 WO disclosed