SCHEMBL14933435

SCHEMBL14933435

O=c1c2cccc3c2c2c(cccc2n3-c2ccccc2)n1-c1cc(-c2ccccc2)cc(-c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 3/20 0.47
POLB P06746 1/20 0.47
TSHR P16473 1/20 0.47
BRCA1 P38398 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPK1 P28482 1/20 0.45
PGR P06401 4/20 0.43
KDM4E B2RXH2 2/20 0.43
ATM Q13315 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
RXFP1 Q9HBX9 1/20 0.40
CYP1A2 P05177 1/20 0.40
GLA P06280 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSP90AA1 P07900 2/20 0.40

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
SCHEMBL14933413 1.00 KMT2A (0.50) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL14933515 0.94 KMT2A (0.48) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL14933410 0.93 KMT2A (0.47) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL14933618 0.89 KMT2A (0.43) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL14933365 0.86 KMT2A (0.47) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL14933422 0.84 MAPK1 (0.61) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL25830681 0.84 KMT2A (0.49) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL23875036 0.84 L3MBTL1 (0.47) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL17019446 0.83 L3MBTL1 (0.55) KMT2AALDH1A1MEN1POLBTSHR
SCHEMBL12698511 0.83 ATM (0.44) KMT2AALDH1A1MEN1POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9337430-B2 Organic electroluminescent device MERCK PATENT GMBH (DE) 2016-05-10 US disclosed
US-9337430-B2 Organic electroluminescent device MERCK PATENT GMBH (DE) 2016-05-10 US disclosed
EP-2773721-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2015-11-25 EP disclosed
US-20140249308-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2014-09-04 US disclosed
US-20140249308-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2014-09-04 US disclosed
WO-2013064206-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2013-05-10 WO disclosed