SCHEMBL31470992

SCHEMBL31470992

CC(Cl)(CCCl)C(=O)O.[Si]

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.36
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
GGT1 P19440 1/20 0.31
ACLY P53396 1/20 0.30
NAALAD2 Q9Y3Q0 1/20 0.30
FFAR1 O14842 1/20 0.30
CPT2 P23786 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL9620057 0.77
SCHEMBL1551665 0.77
SCHEMBL3226980 0.76
SCHEMBL30415576 0.74
SCHEMBL350605 0.74
SCHEMBL1879740 0.74
SCHEMBL607577 0.73 FDPS (0.40) TSHRALDH1A1TP53ACACBACACA
SCHEMBL607576 0.73 FDPS (0.40) TSHRALDH1A1TP53ACACBACACA
SCHEMBL10554883 0.73 CYP4F2 (0.38) TSHRALDH1A1TP53CYP2D6CYP2C19
SCHEMBL2170261 0.71 ACLY (0.36) TSHRALDH1A1TP53CYP2D6CYP2C19

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-119569773-A Preparation method of 2, 2-dimethyl-1-oxa-4-thia-2-silacyclohexane-6-one 内蒙古三友化学有限公司 2025-03-07 CN disclosed