SCHEMBL12439871

SCHEMBL12439871

CCCCc1ccc(N(c2ccc(Br)cc2)c2ccc(-c3ccc(N(c4ccc(Br)cc4)c4ccc(CCCC)cc4)cc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.55
NFKB1 P19838 1/20 0.55
MAPK1 P28482 1/20 0.55
RAB9A P51151 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
RARB P10826 6/20 0.49
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
TAAR1 Q96RJ0 1/20 0.44
NISCH Q9Y2I1 1/20 0.44
HSD17B10 Q99714 2/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
RARA P10276 1/20 0.42
MAPT P10636 1/20 0.42
MTOR P42345 1/20 0.42

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
SCHEMBL4911541 1.00 NPC1 (0.55) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL13475016 1.00 NPC1 (0.55) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL10358431 0.94 SMN1; SMN2 (0.51) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL753213 0.94 SMN1; SMN2 (0.51) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL13475015 0.94 SMN1; SMN2 (0.51) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL1046903 0.94 SMN1; SMN2 (0.51) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL992778 0.94 SMN1; SMN2 (0.51) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL12313750 0.94 SMN1; SMN2 (0.51) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL12313746 0.94 SMN1; SMN2 (0.51) NPC1NFKB1MAPK1RAB9ANFKB2
SCHEMBL12669128 0.94 NPC1 (0.50) NPC1NFKB1MAPK1RAB9ANFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9087993-B2 Cross-linkable polymer, cross-linked material of the cross-linkable polymer, organic light emitting device comprising the cross-linked material and method of preparing the organic light emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-07-21 US disclosed
US-9087993-B2 Cross-linkable polymer, cross-linked material of the cross-linkable polymer, organic light emitting device comprising the cross-linked material and method of preparing the organic light emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-07-21 US disclosed
US-8512879-B2 Polymer for optoelectronic device GENERAL ELECTRIC COMPANY (US) 2013-08-20 US disclosed
US-8512879-B2 Polymer for optoelectronic device GENERAL ELECTRIC COMPANY (US) 2013-08-20 US disclosed
US-20110175069-A1 CROSS-LINKABLE POLYMER, CROSS-LINKED MATERIAL OF THE CROSS-LINKABLE POLYMER, ORGANIC LIGHT EMITTING DEVICE COMPRISING THE CROSS-LINKED MATERIAL AND METHOD OF PREPARING THE ORGANIC LIGHT EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD (KR) 2011-07-21 US disclosed
WO-2011059553-A1 POLYMER FOR OPTOELECTRONIC DEVICE GENERAL ELECTRIC COMPANY (US) 2011-05-19 WO disclosed
US-20110108807-A1 POLYMER FOR OPTOELECTRONIC DEVICE GENERAL ELECTRIC COMPANY (US) 2011-05-12 US disclosed
US-20110108807-A1 POLYMER FOR OPTOELECTRONIC DEVICE GENERAL ELECTRIC COMPANY (US) 2011-05-12 US disclosed
US-20110077373-A1 POLYMER AND OPTOELECTRONIC DEVICE COMPRISING THE SAME GENERAL ELECTRIC COMPANY (US) 2011-03-31 US disclosed
US-20110077373-A1 POLYMER AND OPTOELECTRONIC DEVICE COMPRISING THE SAME GENERAL ELECTRIC COMPANY (US) 2011-03-31 US disclosed
US-7666956-B2 Polymer MERCK PATENT GMBH (DE) 2010-02-23 US disclosed
US-7666956-B2 Polymer MERCK PATENT GMBH (DE) 2010-02-23 US disclosed