SCHEMBL16640921

SCHEMBL16640921

CCO[Si](CCCOc1ccc(N(CC2CO2)CC2CO2)cc1)(OCC)OCC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
ALDH1A1 P00352 5/20 0.33
MAPT P10636 3/20 0.33
HPGD P15428 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
TP53 P04637 2/20 0.33
TSHR P16473 2/20 0.33
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 1/20 0.33
PPARG P37231 1/20 0.33
HIF1A Q16665 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGES O14684 1/20 0.32
GAA P10253 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
CYP19A1 P11511 2/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
PKM P14618 1/20 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
SCHEMBL16640992 0.94 LSS (0.33) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL16640994 0.94 ALDH1A1 (0.34) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL16640941 0.92 PTGES (0.34) LMNAALDH1A1HPGDKDM4ECYP1A2
SCHEMBL17051354 0.87 SMN1; SMN2 (0.36) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL16640990 0.86 ALDH1A1 (0.41) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL21704671 0.82 TDP1 (0.41) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL19901210 0.81
SCHEMBL21704619 0.81 TDP1 (0.42) LMNAALDH1A1MAPTHPGDMEN1
SCHEMBL19901209 0.81
SCHEMBL16640995 0.81 ALDH1A1 (0.34) ALDH1A1MAPTHPGDMEN1KMT2A

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