SCHEMBL28056305

SCHEMBL28056305

Clc1cc(Cl)cc(Nc2ccccn2)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPK10 P53779 1/20 0.53
GFER P55789 1/20 0.53
KDR P35968 1/20 0.49
GRM4 Q14833 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
KDM4E B2RXH2 2/20 0.46
CYP1A1 P04798 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP1B1 Q16678 1/20 0.46
ITGB3 P05106 1/20 0.46
ITGAV P06756 1/20 0.46
GAA P10253 1/20 0.45
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
TYK2 P29597 1/20 0.44
PTK6 Q13882 1/20 0.44
CCR1 P32246 1/20 0.44

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
SCHEMBL6841330 0.86 RAB9A (0.56) MEN1KMT2AKDRNPC1RAB9A
SCHEMBL3957102 0.85 HTR3E (0.58) MEN1KMT2AMAPK10GFERKDR
SCHEMBL6937435 0.83 ITGB3 (0.51) MEN1KMT2AGRM4NPC1RAB9A
SCHEMBL29850051 0.82 NPC1 (0.60) MEN1KMT2AMAPK10GFERKDR
SCHEMBL21258999 0.82 NPC1 (0.60) MEN1KMT2AMAPK10GFERKDR
SCHEMBL31220846 0.78 KMT2A (0.63) MEN1KMT2AMAPK10GFERKDR
SCHEMBL7981759 0.78 KMT2A (0.63) MEN1KMT2AMAPK10GFERKDR
SCHEMBL28415105 0.78 EGFR (0.52) MEN1KMT2AMAPK10GFERKDR
SCHEMBL29408384 0.78 EGFR (0.52) MEN1KMT2AMAPK10GFERKDR
SCHEMBL29582475 0.77 MEN1 (0.64) MEN1KMT2AMAPK10GFERKDR

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
CN-105331447-A Sterilizing cleaning composition with rich and stable foam LI BIDAN 2016-02-17 CN disclosed