SCHEMBL994265

SCHEMBL994265

CC(C)(C)c1ccc(N(c2ccccc2)c2ccc(C3OCCO3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
CYP2C19 P33261 2/20 0.35
CYP2D6 P10635 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM1A O60341 1/20 0.34
KIF11 P52732 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33

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
SCHEMBL16884712 0.87 MEN1 (0.44) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL16501126 0.87 ALDH1A1 (0.35) ALDH1A1LMNASMN1; SMN2CYP2C19CYP3A4
SCHEMBL2680437 0.83 LMNA (0.43) ALDH1A1LMNASMN1; SMN2RAB9AKDM4E
SCHEMBL13720599 0.80 L3MBTL1 (0.50) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL14163852 0.80 L3MBTL1 (0.50) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL14069614 0.80 L3MBTL1 (0.50) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6935203 0.80 L3MBTL1 (0.50) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL14163839 0.80 L3MBTL1 (0.50) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL13720556 0.80 L3MBTL1 (0.50) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL15746013 0.80 L3MBTL1 (0.50) ALDH1A1LMNASMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2273512-B1 Conjugated polymers comprising triarylamine-arylenevinylene units, synthesis and use of the same MERCK PATENT GMBH (DE) 2016-07-20 EP disclosed
EP-2273512-B1 Conjugated polymers comprising triarylamine-arylenevinylene units, synthesis and use of the same MERCK PATENT GMBH (DE) 2016-07-20 EP disclosed
EP-1961016-B1 TRIARYLAMINE-ARYLVINYLENE MOIETY-CONTAINING CONJUGATED POLYMERS, THEIR PRODUCTION AND USE MERCK PATENT GMBH (DE) 2013-06-05 EP disclosed
EP-1961016-B1 TRIARYLAMINE-ARYLVINYLENE MOIETY-CONTAINING CONJUGATED POLYMERS, THEIR PRODUCTION AND USE MERCK PATENT GMBH (DE) 2013-06-05 EP disclosed
EP-2273512-A2 Conjugated polymers comprising triarylamine-arylenevinylene units, synthesis and use of the same Merck Patent GmbH (DE) 2011-01-12 EP disclosed
EP-2273512-A2 Conjugated polymers comprising triarylamine-arylenevinylene units, synthesis and use of the same Merck Patent GmbH (DE) 2011-01-12 EP disclosed
US-7799875-B2 polymeric light emitting diodes; longer operating lifetime; brightness with lower energy; MERCK PATENT GMBH (DE) 2010-09-21 US disclosed
US-7799875-B2 polymeric light emitting diodes; longer operating lifetime; brightness with lower energy; MERCK PATENT GMBH (DE) 2010-09-21 US disclosed
US-7799875-B2 polymeric light emitting diodes; longer operating lifetime; brightness with lower energy; MERCK PATENT GMBH (DE) 2010-09-21 US disclosed
US-20090005505-A1 polymeric light emitting diodes; longer operating lifetime; brightness with lower energy; MERCK PATENT GMBH (DE) 2009-01-01 US disclosed
US-20090005505-A1 polymeric light emitting diodes; longer operating lifetime; brightness with lower energy; MERCK PATENT GMBH (DE) 2009-01-01 US disclosed
US-20090005505-A1 polymeric light emitting diodes; longer operating lifetime; brightness with lower energy; MERCK PATENT GMBH (DE) 2009-01-01 US disclosed
EP-1961016-A1 TRIARYLAMINE-ARYLVINYLENE MOIETY-CONTAINING CONJUGATED POLYMERS, THEIR PRODUCTION AND USE Merck Patent GmbH (DE) 2008-08-27 EP disclosed
WO-2007068325-A1 TRIARYLAMINE-ARYLVINYLENE MOIETY-CONTAINING CONJUGATED POLYMERS, THEIR PRODUCTION AND USE MERCK PATENT GMBH (DE) 2007-06-21 WO disclosed
WO-2007068325-A1 TRIARYLAMINE-ARYLVINYLENE MOIETY-CONTAINING CONJUGATED POLYMERS, THEIR PRODUCTION AND USE MERCK PATENT GMBH (DE) 2007-06-21 WO disclosed