SCHEMBL29240754

SCHEMBL29240754

CCCCCCCSCCC[Si](OCCC)(OCCC)OCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.37
THRB P10828 2/20 0.37
GMNN O75496 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
BLM P54132 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CA2 P00918 1/20 0.36
LMNA P02545 1/20 0.34
PRKD3 O94806 2/20 0.34
PRKCG P05129 2/20 0.34
PRKCB P05771 2/20 0.34
PRKCA P17252 2/20 0.34
PRKCH P24723 2/20 0.34
PRKCI P41743 2/20 0.34
PRKCE Q02156 2/20 0.34
PRKCQ Q04759 2/20 0.34
PRKCZ Q05513 2/20 0.34

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
SCHEMBL29240790 0.92 CES2 (0.37) CES2THRBGMNNTP53POLB
SCHEMBL18091958 0.92
SCHEMBL29240781 0.86 CES2 (0.38) CES2THRBGMNNTP53POLB
SCHEMBL27896800 0.86 CES2 (0.38) CES2THRBGMNNTP53POLB
SCHEMBL25171306 0.86 CES2 (0.38) CES2THRBGMNNTP53POLB
SCHEMBL15023966 0.86 PLA2G4B (0.33) PLA2G4B
SCHEMBL185005 0.83 LMNA (0.41) THRBMAPTCA2LMNATSHR
SCHEMBL15846893 0.83 LMNA (0.41) THRBMAPTCA2LMNATSHR
SCHEMBL180445 0.83 LMNA (0.41) THRBMAPTCA2LMNATSHR
SCHEMBL4616095 0.83 LMNA (0.41) THRBMAPTCA2LMNATSHR

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-117924347-A Preparation method of monosulfur organosilane coupling agent 江西宏柏新材料股份有限公司 2024-04-26 CN disclosed