SCHEMBL28098663

SCHEMBL28098663

CCNCCC[Si](C)(OCC)OC(C)CC

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.34
MEN1 O00255 1/20 0.34
GLA P06280 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
SAT1 P21673 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
SCHEMBL27784716 0.85
SCHEMBL1135938 0.84 CYP2C19 (0.44) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL28098649 0.83 CYP2C19 (0.34) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL27757678 0.83
SCHEMBL28098780 0.82 CYP2C19 (0.39) CYP2C19MEN1GLAKMT2ACYP1A2
Ammonia Solution, Strong SCHEMBL28105810 0.82 CYP2C19 (0.42) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL15360479 0.78 CYP2C19 (0.46) CYP2C19MEN1GLAKMT2ACYP1A2
SCHEMBL1674507 0.77
SCHEMBL29915593 0.76 CA12 (0.32) MEN1KMT2A
SCHEMBL6833531 0.76 TSHR (0.40) CYP2C19MEN1GLAKMT2ACYP1A2

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
CN-102702246-B Amino-acid modified silane compound and preparation method 信越化学工业株式会社 2016-09-28 CN disclosed