SCHEMBL3159352

SCHEMBL3159352

CCCCC(CC)CC1(CC(CC)CCCC)c2cc(Br)ccc2-c2ccc(-c3nnc(-c4ccc5c(c4)C(CC(CC)CCCC)(CC(CC)CCCC)c4cc(Br)ccc4-5)o3)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.38
RAB9A P51151 9/20 0.38
ALDH1A1 P00352 5/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
CYP1A2 P05177 1/20 0.38
TP53 P04637 4/20 0.37
MAPT P10636 4/20 0.37
SMN1; SMN2 Q16637 8/20 0.36
KDM4E B2RXH2 5/20 0.36
LMNA P02545 4/20 0.36
POLB P06746 1/20 0.36
GAA P10253 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
TSHR P16473 6/20 0.35
HSD17B10 Q99714 3/20 0.35
HPGD P15428 2/20 0.32
NFKB1 P19838 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 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
SCHEMBL6018049 0.87 NPC1 (0.37) NPC1RAB9AALDH1A1CYP1A2TP53
SCHEMBL6018363 0.87 MAPT (0.35) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL679081 0.86 ALDH1A1 (0.33) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL29539705 0.86 ALDH1A1 (0.33) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL20233492 0.83
SCHEMBL14081253 0.83 RAB9A (0.35) NPC1RAB9AALDH1A1CYP1A2TP53
SCHEMBL13607204 0.82 MEN1 (0.37) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL5502649 0.82 MEN1 (0.31) NPC1RAB9AKMT2AMEN1MAPT
SCHEMBL10021911 0.80 MAPT (0.32) KMT2AMEN1TP53MAPT
SCHEMBL9898232 0.80 MEN1 (0.39) ALDH1A1KMT2AMEN1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1554361-B1 METALLIC COMPLEXES COVALENTLY BOUND TO CONJUGATED POLYMERS AND ELECTRONIC DEVICES CONTAINING SUCH COMPOSITIONS DU PONT (US) 2010-03-17 EP disclosed
US-7138483-B2 Monomers, conjugated polymers and electronic devices using such polymers E.I. DU PONT DE NEMOURS AND COMPANY (US) 2006-11-21 US disclosed
US-7115899-B2 Light-emitting copolymers and electronic devices using such copolymers E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-10-03 US disclosed
US-20060192198-A1 LIGHT-EMITTING COPOLYMERS AND ELECTRONIC DEVICES USING SUCH COPOLYMERS LG CHEM, LTD. (KR) 2006-08-31 US disclosed
US-7090929-B2 Metallic complexes covalently bound to conjugated polymers and electronic devices containing such compositions E.I. DU PONT DE NEMOURS AND COMPANY (US) 2006-08-15 US disclosed
WO-2005042176-A9 LIGHT-EMITTING COPOLYMERS AND ELECTRONIC DEVICES USING SUCH COPOLYMERS DU PONT (US) 2006-01-05 WO disclosed
EP-1554361-A1 METALLIC COMPLEXES COVALENTLY BOUND TO CONJUGATED POLYMERS AND ELECTRONIC DEVICES CONTAINING SUCH COMPOSITIONS E. I. du Pont de Nemours and Company (US) 2005-07-20 EP disclosed
US-20040192871-A1 Monomers, conjugated polymers and electronic devices using such polymers E. I. DU PONT DE NEMOURS AND COMPANY 2004-09-30 US disclosed
WO-2004072123-A2 MONOMERS, CONJUGATED POLYMERS AND ELECTRONIC DEVICES USING SUCH POLYMERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2004-08-26 WO disclosed
US-20040072018-A1 Metallic complexes covalently bound to conjugated polymers and electronic devices containing such compositions LG CHEM, LTD. (KR) 2004-04-15 US disclosed
WO-2004015025-A1 METALLIC COMPLEXES COVALENTLY BOUND TO CONJUGATED POLYMERS AND ELECTRONIC DEVICES CONTAINING SUCH COMPOSITIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2004-02-19 WO disclosed