SCHEMBL13136830

SCHEMBL13136830

Cc1cccc(N(c2ccc(N(c3cccc(C)c3)c3ccc(C)c(C)c3)cc2)c2ccc(C)c(C)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.42
S1PR1 P21453 1/20 0.41
EGFR P00533 2/20 0.40
CSF1R P07333 2/20 0.40
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
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
ALDH1A1 P00352 5/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 2/20 0.35
TSHR P16473 1/20 0.35
HSD17B1 P14061 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
SCHEMBL13569450 0.98 ACHE (0.44) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL10706937 0.96 ALDH1A1 (0.41) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL15957828 0.96 ACHE (0.39) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL12677671 0.94 HSD17B1 (0.42) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL18286391 0.91 HSD17B1 (0.40) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL11911545 0.91 HSD17B1 (0.40) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL13030513 0.90 S1PR1 (0.35) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL13242002 0.90 HSD17B1 (0.42) ACHES1PR1EGFRCSF1RNPC1
SCHEMBL4518120 0.89 ACHE (0.52) ACHEEGFRCSF1RNPC1RAB9A
SCHEMBL728283 0.89 ACHE (0.52) ACHEEGFRCSF1RNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404412-B2 Electrophotographic photoreceptor, and image forming apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2013-03-26 US disclosed
US-20100221040-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR AND APPARATUS FOR IMAGE FORMATION MITSUBISHI CHEMICAL CORPORATION 2010-09-02 US disclosed