SCHEMBL3446113

SCHEMBL3446113

Cc1ccc(N(c2ccc(Br)cc2)c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(Br)cc4)cc3)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
MAPK1 P28482 1/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
APP P05067 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MAOB P27338 1/20 0.38
PAX8 Q06710 1/20 0.38
GAA P10253 1/20 0.37
ACHE P22303 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP2A6 P11509 1/20 0.36
AHR P35869 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL1960043 1.00 ALDH1A1 (0.59) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL346046 1.00 ALDH1A1 (0.59) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL23714860 0.93 ALDH1A1 (0.68) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL3853531 0.93 ALDH1A1 (0.68) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL106962 0.93 ALDH1A1 (0.68) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL2858875 0.93 ALDH1A1 (0.68) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL13990452 0.93 ALDH1A1 (0.68) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL13259842 0.92 ALDH1A1 (0.52) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL15583743 0.92 ALDH1A1 (0.58) ALDH1A1MAPK1TSHRMEN1CYP1A2
SCHEMBL6744563 0.92 ALDH1A1 (0.52) ALDH1A1MAPK1TSHRMEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2471833-B1 Polymer, composition, liquid composition, and conductive thin film SUMITOMO CHEMICAL CO (JP) 2013-08-28 EP disclosed
US-8384066-B2 Polymer light-emitting device, polymer compound, composition, liquid composition, and conductive thin film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-26 US disclosed
EP-2471833-A1 Polymer, composition, liquid composition, and conductive thin film SUMITOMO CHEMICAL CO., LTD. (JP) 2012-07-04 EP disclosed
US-20100090206-A1 POLYMER LIGHT-EMITTING DEVICE, POLYMER COMPOUND, COMPOSITION, LIQUID COMPOSITION, AND CONDUCTIVE THIN FILM SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-15 US disclosed
EP-2110399-A1 POLYMER LIGHT-EMITTING DEVICE, POLYMER COMPOUND, COMPOSITION, LIQUID COMPOSITION, AND CONDUCTIVE THIN FILM Sumitomo Chemical Company, Limited (JP) 2009-10-21 EP disclosed
US-20070003783-A1 Quinoline copolymer and organic electroluminescent device employing same HITACHI CHEMICAL CO LTD (JP) 2007-01-04 US disclosed
US-20070003783-A1 Quinoline copolymer and organic electroluminescent device employing same HITACHI CHEMICAL CO LTD (JP) 2007-01-04 US disclosed
US-5929194-A POLY(TERT-DI OR POLYARYLAMINE) CONTAINING END GROUPS, IN EACH OCCURANCE SELECTED BY HYDROXY, GLYCIDYL ETHER, ACRYLATE OR METHACRYLATES, ETHENYL, ETHYNYL, VINYLBENZOXY, IMIDES, TRIFLUROVINYL ETHER AND BOUNDED CYCLOBUTENE THE DOW CHEMICAL COMPANY (US) 1999-07-27 US disclosed
WO-1997033193-A2 CROSS-LINKABLE OR CHAIN EXTENDABLE POLYARYLPOLYAMINES AND FILMS THEREOF THE DOW CHEMICAL COMPANY (US) 1997-09-12 WO disclosed