SCHEMBL8764993

SCHEMBL8764993

Cc1cc(C)cc(N(c2cc(C)cc(C)c2)c2cccc(N(c3cc(C)cc(C)c3)c3cc(C)cc(C)c3)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.46
ALDH1A1 P00352 6/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSPO P30536 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
TSHR P16473 2/20 0.33
HSD17B1 P14061 2/20 0.33
HSD17B2 P37059 2/20 0.33
MAPK1 P28482 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
THRB P10828 1/20 0.31

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
SCHEMBL883714 0.93 ACHE (0.57) ACHEALDH1A1TDP1CYP1A2CYP3A4
SCHEMBL8766625 0.93 ACHE (0.50) ACHEALDH1A1TDP1CYP1A2CYP3A4
SCHEMBL29391727 0.90 ACHE (0.52) ACHEALDH1A1TDP1CYP1A2CYP3A4
SCHEMBL147931 0.90 ACHE (0.52) ACHEALDH1A1TDP1CYP1A2CYP3A4
SCHEMBL134721 0.87 ACHE (0.55) ACHEALDH1A1TDP1CYP1A2CYP3A4
SCHEMBL29692933 0.87 ACHE (0.55) ACHEALDH1A1TDP1CYP1A2CYP3A4
SCHEMBL13715580 0.87 ACHE (0.44) ACHEALDH1A1TDP1KDM4ECYP1A2
SCHEMBL22813419 0.87 ACHE (0.44) ACHEALDH1A1TDP1KDM4ECYP1A2
SCHEMBL8764966 0.87 ALDH1A1 (0.42) ACHEALDH1A1TDP1CYP3A4TSPO
SCHEMBL8766574 0.85 ALDH1A1 (0.46) ACHEALDH1A1TDP1KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0420207-B1 Electrophotosensitive material and method of manufacturing the same MITA INDUSTRIAL CO LTD (JP) 1997-08-13 EP disclosed
US-5185228-A Binder resin, charge transfer material; stability MITA INDUSTRIAL CO., LTD. (JP) 1993-02-09 US disclosed
US-5128229-A Polycarbonate, m-phenylenediamine derivative MITA INDUSTRIAL CO., LTD. (JP) 1992-07-07 US disclosed
EP-0420207-A2 Electrophotosensitive material and method of manufacturing the same MITA INDUSTRIAL CO. LTD. (JP) 1991-04-03 EP disclosed
EP-0413338-A1 Electrophotosensitive material MITA INDUSTRIAL CO. LTD. (JP) 1991-02-20 EP disclosed