SCHEMBL13833004

SCHEMBL13833004

CC1(C)c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2-c2cc(P(=O)(c3ccccc3)c3ccccc3)ccc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 10/20 0.35
▸ LMNA P02545 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ITGB2 P05107 1/20 0.32
▸ ICAM1 P05362 1/20 0.32
▸ ITGAL P20701 1/20 0.32
▸ HTT P42858 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ ALOX15 P16050 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ NPSR1 Q6W5P4 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
SCHEMBL13833002 0.94 PGR (0.33) PGRLMNAMEN1KMT2AITGB2
SCHEMBL13231589 0.87 LMNA (0.39) PGRLMNAMEN1KMT2AITGB2
SCHEMBL21510253 0.84 LMNA (0.32) LMNAMEN1KMT2AITGB2ICAM1
SCHEMBL14076799 0.84 LMNA (0.43) PGRLMNAMEN1KMT2AMAPT
SCHEMBL13231552 0.84 PGR (0.40) PGRLMNAMEN1KMT2AITGB2
SCHEMBL13231623 0.83 PGR (0.38) PGRLMNAMEN1KMT2AITGB2
SCHEMBL19797411 0.81 ITGB2 (0.39) PGRLMNAMEN1KMT2AITGB2
SCHEMBL13833018 0.81 MEN1 (0.32) LMNAMEN1KMT2AITGB2ICAM1
SCHEMBL13833016 0.81 ALDH1A1 (0.42) PGRLMNAMEN1KMT2AITGB2
SCHEMBL13832997 0.80 NPSR1 (0.32) MEN1KMT2AMAPTKDM4ENPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10177312-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2019-01-08 — — US disclosed
EP-2705550-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-07-05 — — EP disclosed
US-20140070146-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2014-03-13 — — US disclosed
US-20140070146-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2014-03-13 — — US disclosed
WO-2012149999-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-08 — — WO disclosed
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