SCHEMBL17401210

SCHEMBL17401210

Cc1cccc(N(c2ccc(N(C)C)cc2)c2cccc(N(c3ccc(N(C)C)cc3)c3cccc(C)c3)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
TDP1 Q9NUW8 3/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
NSD2 O96028 1/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
ALDH1A1 P00352 6/20 0.48
TSHR P16473 5/20 0.48
ALOX15 P16050 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ACHE P22303 1/20 0.42
KCNK3 O14649 1/20 0.42
SIGMAR1 Q99720 1/20 0.40
HTT P42858 1/20 0.38
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38

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
SCHEMBL728283 0.89 ACHE (0.52) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL4518120 0.89 ACHE (0.52) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL10065954 0.88 ALDH1A1 (0.46) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL7741726 0.88 ACHE (0.46) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL10065562 0.88 ALDH1A1 (0.46) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL2059632 0.88 ALDH1A1 (0.46) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL134721 0.87 ACHE (0.55) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL29692933 0.87 ACHE (0.55) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL5609308 0.86 APP (0.49) MEN1KMT2ATDP1NPC1RAB9A
SCHEMBL19075300 0.85 ACHE (0.48) MEN1KMT2ATDP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160005994-A1 ORGANIC ELECTROLUMINESCENCE DEVICE NIPPON HOSO KYOKAI (JP) 2016-01-07 US disclosed