SCHEMBL14200065

SCHEMBL14200065

CCC(C)c1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(C(C)CC)cc4)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 1/20 0.45
CYP2C9 P11712 1/20 0.40
ACHE P22303 1/20 0.40
ALDH1A1 P00352 3/20 0.37
TSHR P16473 3/20 0.37
STAT3 P40763 1/20 0.37
CHRNA7 P36544 1/20 0.36
USP2 O75604 1/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX5 P09917 1/20 0.36
HRH3 Q9Y5N1 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
SCHEMBL14592726 1.00 GRIA4 (0.45) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL12016670 1.00 GRIA4 (0.45) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL14169208 1.00 GRIA4 (0.45) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL2607396 0.94 CYP2C9 (0.43) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL13883743 0.94 CYP2C9 (0.43) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL12619660 0.93 GRIA4 (0.41) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL13897757 0.93 GRIA4 (0.41) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL19187759 0.90 GRIA4 (0.51) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL12619723 0.89 GRIA4 (0.43) GRIA4CYP2C9ACHEALDH1A1TSHR
SCHEMBL16450313 0.89 GRIA4 (0.38) GRIA4CYP2C9ACHEALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9574084-B2 Hole transport composition E I DU PONT DE NEMOURS AND COMPANY (US) 2017-02-21 US disclosed
US-20130150536-A1 HOLE TRANSPORT COMPOSITION E I DU PONT DE NEMOURS AND COMPANY (US) 2013-06-13 US disclosed
US-8440324-B2 Compositions comprising novel copolymers and electronic devices made with such compositions E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-14 US disclosed
US-8343381-B1 Hole transport composition E I DU PONT DE NEMOURS AND COMPANY (US) 2013-01-01 US disclosed
US-20080097076-A1 HOLE TRANSPORT POLYMERS E. I. DU PONT DE NEMOURS AND COMPANY 2008-04-24 US disclosed
US-20070228364-A1 Compositions comprising novel copolymers and electronic devices made with such compositions LG CHEM, LTD. (KR) 2007-10-04 US disclosed