SCHEMBL807664

SCHEMBL807664

Nc1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccc(N)cc3)c(-c3ccccc3)c2-c2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.78
TDP1 Q9NUW8 3/20 0.78
HSD17B10 Q99714 2/20 0.78
TAAR1 Q96RJ0 1/20 0.78
ALDH1A1 P00352 6/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
MAPT P10636 8/20 0.52
KDM4E B2RXH2 3/20 0.52
HPGD P15428 2/20 0.52
GLA P06280 1/20 0.52
ALOX15 P16050 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ACHE P22303 2/20 0.48
MAOA P21397 4/20 0.46
HTT P42858 3/20 0.46

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
SCHEMBL20323054 1.00 CYP3A4 (0.78) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL13310879 1.00 CYP3A4 (0.78) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL39988 0.92 CYP3A4 (0.67) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL10522604 0.92 CYP3A4 (0.67) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL12478795 0.90 CYP3A4 (0.71) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL1720548 0.90 CYP3A4 (0.71) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL14733298 0.88 TDP1 (0.61) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL24524183 0.88 CYP3A4 (1.00) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
Biphenyl-4-Amine SCHEMBL15921057 0.88 CYP3A4 (1.00) CYP3A4TDP1HSD17B10TAAR1ALDH1A1
SCHEMBL21392391 0.88 CYP3A4 (1.00) CYP3A4TDP1HSD17B10TAAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050239994-A1 Liquid crystal poly(phenylene sulfonic acids) CASE WESTERN RESERVE UNIVERSITY 2005-10-27 US claimed
US-6586561-B1 Fuel cell membranes CASE WESTERN RESERVE UNIVERSITY 2003-07-01 US claimed
EP-2616493-B1 POLYMERISATION METHOD UNIV COURT UNIV OF EDINBURGH (GB) 2020-07-01 EP disclosed
EP-2616493-B1 POLYMERISATION METHOD UNIV COURT UNIV OF EDINBURGH (GB) 2020-07-01 EP disclosed
US-9018270-B2 Method for producing polymers comprising multiple repeat units of bicyclic diamines UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2015-04-28 US disclosed
US-9018270-B2 Method for producing polymers comprising multiple repeat units of bicyclic diamines UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2015-04-28 US disclosed
US-9018270-B2 Method for producing polymers comprising multiple repeat units of bicyclic diamines UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2015-04-28 US disclosed
US-20130267616-A1 Polymerisation Method UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2013-10-10 US disclosed
US-20130267616-A1 Polymerisation Method UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2013-10-10 US disclosed
US-20130267616-A1 Polymerisation Method UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2013-10-10 US disclosed
WO-2012035327-A1 POLYMERISATION METHOD UNIVERSITY COLLEGE CARDIFF CONSULTANTS LIMITED (GB) 2012-03-22 WO disclosed
US-20090259013-A1 LIQUID CRYSTAL POLY(PHENYLENE DISULFONIC ACIDS) CASE WESTERN RESERVE UNIVERSITY 2009-10-15 US disclosed
US-7375176-B2 Liquid crystal poly(phenylene sulfonic acids) CASE WESTERN RESERVE UNIVERSITY 2008-05-20 US disclosed
US-20050239994-A1 Liquid crystal poly(phenylene sulfonic acids) CASE WESTERN RESERVE UNIVERSITY 2005-10-27 US disclosed
US-6586561-B1 Fuel cell membranes CASE WESTERN RESERVE UNIVERSITY 2003-07-01 US disclosed
US-5087691-A Poly-phenylated diamines and their use as polycondensation monomers in the synthesis of polyamide, poly(amide-imide), and polyimide polymers UNIVERSITY OF AKRON (US) 1992-02-11 US disclosed