SCHEMBL8764994

SCHEMBL8764994

Cc1ccc(N(c2cccc(C)c2)c2cc(C)cc(N(c3ccc(C)cc3)c3cccc(C)c3)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.42
HSD17B1 P14061 4/20 0.40
HSD17B2 P37059 4/20 0.40
ALDH1A1 P00352 5/20 0.38
TSHR P16473 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
TP53 P04637 1/20 0.38
GPX4 P36969 1/20 0.38
PAX8 Q06710 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
NSD2 O96028 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
MAPK1 P28482 1/20 0.35

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
SCHEMBL7741726 0.96 ACHE (0.46) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL3441917 0.94 ACHE (0.48) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL403133 0.94 ACHE (0.48) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL19075300 0.94 ACHE (0.48) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL10066016 0.94 ACHE (0.48) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL16158477 0.94 ACHE (0.48) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL22099589 0.92 ALDH1A1 (0.44) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL8766625 0.92 ACHE (0.50) ACHEHSD17B1HSD17B2ALDH1A1NPC1
SCHEMBL15603561 0.91 ACHE (0.43) ACHEHSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL22813419 0.90 ACHE (0.44) ACHEALDH1A1TSHRNPC1RAB9A

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
EP-0420207-B1 Electrophotosensitive material and method of manufacturing the same MITA INDUSTRIAL CO LTD (JP) 1997-08-13 EP disclosed
EP-0390196-B1 Electrophotosensitive material MITA INDUSTRIAL CO LTD (JP) 1995-09-20 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
US-5059503-A Used for copying machine MITA INDUSTRIAL CO., LTD. (JP) 1991-10-22 US disclosed
EP-0390196-A2 Electrophotosensitive material MITA INDUSTRIAL CO., LTD. (JP) 1990-10-03 EP disclosed