SCHEMBL4870800

SCHEMBL4870800

C=Cc1ccc(OCC)cc1[SiH](C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.42
KMT2A Q03164 5/20 0.39
TSHR P16473 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HSD17B10 Q99714 4/20 0.39
TP53 P04637 3/20 0.39
CYP3A4 P08684 2/20 0.39
MEN1 O00255 3/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 3/20 0.37
APOBEC3G Q9HC16 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
HPGD P15428 4/20 0.36
MAPT P10636 3/20 0.36
ESR2 Q92731 1/20 0.36
KDM4E B2RXH2 3/20 0.35
LMNA P02545 3/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RELA Q04206 2/20 0.35

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
SCHEMBL4872017 0.81 CYP1A2 (0.44) KMT2ATSHRALDH1A1HSD17B10TP53
SCHEMBL3623618 0.77 KDM4E (0.47) NQO1KMT2ATSHRALDH1A1HSD17B10
SCHEMBL8759292 0.77
SCHEMBL4874384 0.77 KIF11 (0.34)
SCHEMBL1794282 0.76 NQO1 (0.45) NQO1KMT2ATSHRALDH1A1HSD17B10
SCHEMBL28347627 0.75 CYP1A1 (0.50) NQO1KMT2ATSHRALDH1A1HSD17B10
SCHEMBL8173931 0.74 NQO1 (0.46) NQO1KMT2ATSHRALDH1A1HSD17B10
SCHEMBL16959829 0.74 NQO1 (0.46) NQO1KMT2ATSHRALDH1A1HSD17B10
SCHEMBL8769864 0.74 TRPA1 (0.35) ALDH1A1HSD17B10HTTNPC1MAPT
SCHEMBL16310074 0.72 NQO1 (0.45) NQO1KMT2ATSHRALDH1A1HSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107561-A1 Siloxane monomer containing trifluorovinylether group and sol-gel hybrid polymer prepared by using the same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2005-05-19 US claimed
US-7368514-B2 Siloxane monomer containing trifluorovinylether group and sol-gel hybrid polymer prepared by using the same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2008-05-06 US disclosed
US-20050107561-A1 Siloxane monomer containing trifluorovinylether group and sol-gel hybrid polymer prepared by using the same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2005-05-19 US disclosed