SCHEMBL14933448

SCHEMBL14933448

CC1(C)c2ccccc2-c2ccc(-n3c(=O)c4cccc5c4c4c(cccc43)c(=O)n5-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 9/20 0.37
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 4/20 0.34
HPGD P15428 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
POLB P06746 2/20 0.33
KMT2A Q03164 2/20 0.33
HSD17B10 Q99714 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.33
TSHR P16473 1/20 0.33
BRCA1 P38398 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
CYP1A2 P05177 1/20 0.32
GLA P06280 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL14933572 0.88 PGR (0.37) PGRKDM4ELMNAGAAKMT2A
SCHEMBL18020231 0.86 PGR (0.41) PGRKMT2ANPSR1MEN1
SCHEMBL18121218 0.85 KDM4E (0.35) PGRKDM4E
SCHEMBL14933436 0.85 POLB (0.35) ALDH1A1HPGDLMNAGAAPOLB
SCHEMBL18020199 0.85 PGR (0.43) PGRPDE4APDE4BPDE4CPDE4D
SCHEMBL19359883 0.84 KDM4E (0.38) PGRKDM4EPDE4APDE4BPDE4C
SCHEMBL14933411 0.84 MAPT (0.37) PGRKDM4ELMNANPSR1MAPT
SCHEMBL15999690 0.83 PGR (0.36) PGRKDM4ENPSR1
SCHEMBL17197556 0.83 PGR (0.42) PGRKDM4EALDH1A1HPGDGAA
SCHEMBL14933566 0.83 MAPT (0.40) PGRKDM4EALDH1A1HPGDLMNA

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