SCHEMBL16640925

SCHEMBL16640925

CCCCNC(=O)N(CC1CO1)c1ccc(OCC2CO2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
HPGD P15428 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TP53 P04637 2/20 0.40
MAPT P10636 2/20 0.40
TSHR P16473 2/20 0.40
ALDH1A1 P00352 2/20 0.40
PKM P14618 2/20 0.40
CYP1A2 P05177 1/20 0.40
PPARG P37231 1/20 0.40
HIF1A Q16665 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
MGLL Q99685 1/20 0.39
BCHE P06276 2/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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 0.88 ALDH1A1 (0.36) ALOX5HPGDMEN1KMT2ATP53
SCHEMBL16640924 0.87 ALOX5 (0.44) ALOX5HPGDMEN1KMT2ATP53
SCHEMBL16640938 0.84 ALOX5 (0.45) ALOX5HPGDKMT2AMAPTTSHR
SCHEMBL16641028 0.82 ALOX5 (0.43) ALOX5HPGDMEN1KMT2ATP53
SCHEMBL16640995 0.80 ALDH1A1 (0.34) ALOX5HPGDMEN1KMT2AMAPT
SCHEMBL16640966 0.80 ALOX5 (0.44) ALOX5HPGDMEN1KMT2AMAPT
SCHEMBL16640923 0.79 MGLL (0.43) MGLLBCHE
SCHEMBL16641026 0.78 ALOX5 (0.43) ALOX5HPGDMEN1KMT2ATP53
SCHEMBL16641025 0.78 ALOX5 (0.41) ALOX5HPGDMEN1KMT2ATP53
SCHEMBL16641016 0.76 ALOX5 (0.39) ALOX5HPGDMEN1KMT2AMAPT

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