SCHEMBL17811595

SCHEMBL17811595

Cc1cc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)ccc1-c1ccccc1-c1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)cc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ESR2 Q92731 1/20 0.42
MEN1 O00255 1/20 0.42
APAF1 O14727 1/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
THRB P10828 1/20 0.42
XBP1 P17861 1/20 0.42
PTBP1 P26599 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
GALK1 P51570 1/20 0.42
BLM P54132 1/20 0.42
SMAD3 P84022 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CA12 O43570 2/20 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
SCHEMBL2604754 0.96 ESR2 (0.44) MAPTL3MBTL1ESR2MEN1APAF1
SCHEMBL2604759 0.95 ESR2 (0.43) MAPTL3MBTL1ESR2MEN1APAF1
SCHEMBL2604756 0.95 ESR2 (0.43) MAPTL3MBTL1ESR2MEN1APAF1
SCHEMBL16684006 0.93 MCL1 (0.40) MAPTL3MBTL1ESR2MEN1APAF1
SCHEMBL13990075 0.93 L3MBTL1 (0.42) MAPTL3MBTL1ESR2MEN1APAF1
SCHEMBL14179890 0.91 ESR2 (0.41) MAPTL3MBTL1ESR2MEN1NPC1
SCHEMBL14899560 0.91 MCL1 (0.41) MAPTL3MBTL1ESR2MEN1APAF1
SCHEMBL12914259 0.91 MCL1 (0.39) ESR2CA12CA1CA2CA9
SCHEMBL17199756 0.91 ESR2 (0.52) MAPTL3MBTL1ESR2MEN1APAF1
SCHEMBL15870794 0.91 ESR2 (0.52) MAPTL3MBTL1ESR2MEN1APAF1

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-20160163982-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163982-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-09 US disclosed