SCHEMBL20650243

SCHEMBL20650243

C[Si](C)(C)c1ccc(N(I)c2cccc3c2oc2ccccc23)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.35
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
CYP2C19 P33261 1/20 0.33
LIMK1 P53667 1/20 0.33
KDM4E B2RXH2 5/20 0.32
ALDH1A1 P00352 5/20 0.32
HPGD P15428 3/20 0.32
GAA P10253 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAOA P21397 3/20 0.32
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
LMNA P02545 2/20 0.32
AHR P35869 1/20 0.32
DRD4 P21917 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
USP2 O75604 1/20 0.32
HTT P42858 1/20 0.32
MAPT P10636 3/20 0.31

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
SCHEMBL20650381 0.85 ALOX5 (0.39) ALOX5MEN1KMT2ACYP2C19LIMK1
SCHEMBL21020262 0.84 ALOX5 (0.35) ALOX5MEN1KMT2ACYP2C19KDM4E
SCHEMBL20650298 0.83 MCL1 (0.33)
SCHEMBL20650734 0.83 ALOX5 (0.40) ALOX5MEN1KMT2AKDM4EALDH1A1
SCHEMBL20650251 0.83 MAPT (0.37) ALOX5MEN1KMT2ACYP2C19KDM4E
SCHEMBL23967756 0.82
SCHEMBL20649813 0.82 MEN1 (0.35) ALOX5MEN1KMT2ACYP2C19KDM4E
SCHEMBL20650769 0.82 CYP2C19 (0.40) ALOX5MEN1KMT2ACYP2C19AHR
SCHEMBL20649814 0.82 TNKS (0.40) ALOX5MEN1KMT2ACYP2C19KDM4E
SCHEMBL14295588 0.82 ALOX5 (0.38) ALOX5MEN1KMT2ACYP2C19KDM4E

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
EP-3428152-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG Chem, Ltd. (KR) 2019-01-16 EP disclosed