SCHEMBL13827271

SCHEMBL13827271

c1ccc(-c2ccc(N3c4ccccc4C(c4ccccc4)(c4ccccc4)c4cc(-c5ccc6oc7ccccc7c6c5)ccc43)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.38
PLA2G4A P47712 4/20 0.38
PRKDC P78527 3/20 0.34
PLA2G10 O15496 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AHR P35869 1/20 0.31
PTGER4 P35408 1/20 0.30
CASP3 P42574 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL13827518 0.98 PLA2G2A (0.37) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL13827514 0.98 PLA2G2A (0.37) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL13827888 0.97 PLA2G2A (0.40) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL17197547 0.94 PLA2G2A (0.40) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL13827886 0.93 PLA2G2A (0.37) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL13827513 0.90 PLA2G2A (0.36) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL15030692 0.89 PLA2G2A (0.36) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL13827882 0.89 PLA2G2A (0.39) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL13827534 0.89 PLA2G2A (0.35) PLA2G2APLA2G4APRKDCPLA2G10KDM4E
SCHEMBL17197550 0.87 MMP12 (0.38) PLA2G2APLA2G4APRKDCPLA2G10KDM4E

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
EP-2705552-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-03-04 EP disclosed
US-20140061548-A1 COMPOUNDS FOR ELECTRONIC DEVICES Merck Patent CmbH (DE) 2014-03-06 US disclosed
US-20140061548-A1 COMPOUNDS FOR ELECTRONIC DEVICES Merck Patent CmbH (DE) 2014-03-06 US disclosed
WO-2012150001-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-08 WO disclosed