SCHEMBL16640995

SCHEMBL16640995

CCO[Si](CCCNC(=O)N(CC1CO1)c1ccc(OCCC[Si](OCC)(OCC)OCC)cc1)(OCC)OCC

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
RECQL P46063 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
ALOX5 P09917 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ACACB O00763 1/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL16640997 0.93 ALDH1A1 (0.36) ALDH1A1NPC1RAB9AKDM4EGAA
SCHEMBL16640996 0.89 MGLL (0.40)
SCHEMBL16640923 0.87 MGLL (0.43)
SCHEMBL19901222 0.86 TP53 (0.34) ALDH1A1RAB9AMAPTALOX5HPGD
SCHEMBL19901221 0.83 ALOX5 (0.33) ALDH1A1MAPTALOX5HPGDMEN1
SCHEMBL16640944 0.83 TP53 (0.32) ALDH1A1MAPTALOX5HPGDMEN1
SCHEMBL16640957 0.81 ALOX5 (0.38) ALDH1A1MAPTALOX5HPGDMEN1
SCHEMBL16640921 0.81 LMNA (0.34) ALDH1A1KDM4EGAAMAPTSMN1; SMN2
SCHEMBL16640925 0.80 ALOX5 (0.42) ALDH1A1NPC1RAB9AGAAMAPT
SCHEMBL16640994 0.78 ALDH1A1 (0.34) ALDH1A1KDM4EGAAMAPTSMN1; SMN2

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-9902803-B2 Epoxy compound having alkoxy silyl group, composition comprising same, cured product, use thereof and method for preparing epoxy compound having alkoxy silyl group KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2018-02-27 US disclosed
US-20150105493-A1 EPOXY COMPOUND HAVING ALKOXY SILYL GROUP, COMPOSITION COMPRISING SAME, CURED PRODUCT, USE THEREOF AND METHOD FOR PREPARING EPOXY COMPOUND HAVING ALKOXY SILYL GROUP KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-04-16 US disclosed