SCHEMBL6350642

SCHEMBL6350642

Nc1cccc(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.43
PTGS1 P23219 1/20 0.43
ADORA2A P29274 2/20 0.42
ADORA1 P30542 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
TDO2 P48775 1/20 0.40
PTPRC P08575 1/20 0.39
CYP1A2 P05177 2/20 0.39
PARP1 P09874 1/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SLC22A1 O15245 1/20 0.39
DHFR P00374 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
HEXA P06865 1/20 0.39

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
SCHEMBL9239435 0.84 CYP1A2 (0.48) PTGS2PTGS1ADORA2AADORA1ALDH1A1
SCHEMBL138249 0.83 ALDH1A1 (0.44) ADORA2AALDH1A1HSD17B10PTPRCMEN1
SCHEMBL13729960 0.81 PTGS2 (0.44) PTGS2PTGS1ADORA2AADORA1ALDH1A1
SCHEMBL18045125 0.81 ALDH1A1 (0.60) ADORA2AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL395875 0.80 ALDH1A1 (0.65) PTGS2PTGS1ADORA2AADORA1ALDH1A1
SCHEMBL140573 0.80 ALDH1A1 (0.65) ADORA2AALDH1A1HSD17B10NPC1RAB9A
SCHEMBL6669071 0.80 PTGS2 (0.45) PTGS2PTGS1ADORA2AADORA1ALDH1A1
SCHEMBL15954483 0.79 PLK4 (0.45) ADORA2AADORA1ALDH1A1HSD17B10NPC1
SCHEMBL4328698 0.79 NPC1 (0.46) PTGS2PTGS1ADORA2AADORA1ALDH1A1
SCHEMBL4843094 0.79 ADORA2A (0.50) PTGS2PTGS1ADORA2AALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001068740-A1 CHARGE TRANSPORT MATERIALS AVECIA LIMITED (GB) 2001-09-20 WO claimed
US-10121970-B2 Transistors and methods for making them WUHAN XINQU CHUANGROU OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2018-11-06 US disclosed
EP-2715819-B1 SEMICONDUCTOR COMPOUNDS NEUDRIVE LTD (GB) 2018-03-21 EP disclosed
EP-2715820-B1 SEMICONDUCTOR COMPOSITIONS FOR ORGANIC TRANSISTORS NEUDRIVE LTD (GB) 2018-02-14 EP disclosed
US-20170005269-A1 TRANSISTORS AND METHODS FOR MAKING THEM SILVERRAY LTD. (GB) 2017-01-05 US disclosed
US-9431145-B2 Transistors and methods for making them NEUDRIVE LIMITED (GB) 2016-08-30 US disclosed
US-9406886-B2 Semiconductor compounds NEUDRIVE LIMITED (GB) 2016-08-02 US disclosed
US-20140175409-A1 TRANSISTORS AND METHODS FOR MAKING THEM CENTRE FOR PROCESS INNOVATION LIMITED (GB) 2014-06-26 US disclosed
US-20140114040-A1 SEMICONDUCTOR COMPOUNDS PEAKDALE MOLECULAR LIMITED (GB) 2014-04-24 US disclosed
WO-2012160382-A1 SEMICONDUCTOR COMPOUNDS THE CENTRE FOR PROCESS INNOVATION LTD (GB) 2012-11-29 WO disclosed
WO-2012160383-A1 TRANSISTORS AND METHODS FOR MAKING THEM THE CENTRE FOR PROCESS INNOVATION LTD (GB) 2012-11-29 WO disclosed
US-6858703-B2 Compound, compositions and use AVECIA LIMITED (GB) 2005-02-22 US disclosed
US-20040054095-A1 Compound, compositions and use AVECIA LIMITED OF BLACKLEY (GB) 2004-03-18 US disclosed
US-6630566-B1 Polymeric material comprising at least one repeat unit, the or each (if more than one) repeat unit consisting substantially of a moiety of Formula I:For photocopiers AVECIA LIMITED (GB) 2003-10-07 US disclosed
EP-1040152-B1 POLYMERIC MATERIAL COMPRISING N, P, S, AS OR SE AND COMPOSITION FOR CHARGE TRANSPORT MATERIAL AVECIA LTD (GB) 2002-10-16 EP disclosed
WO-2001068740-A1 CHARGE TRANSPORT MATERIALS AVECIA LIMITED (GB) 2001-09-20 WO disclosed
EP-1040152-A1 POLYMERIC MATERIAL COMPRISING N, P, S, AS OR SE AND COMPOSITION FOR CHARGE TRANSPORT MATERIAL Avecia Limited (GB) 2000-10-04 EP disclosed
WO-1999032537-A1 POLYMERIC MATERIAL COMPRISING N, P, S, As OR Se AND COMPOSITION FOR CHARGE TRANSPORT MATERIAL AVECIA LIMITED (GB) 1999-07-01 WO disclosed