SCHEMBL4435873

SCHEMBL4435873

Cc1cccc([SiH2]O[SiH2]O)c1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 3/20 0.34
HTR1B P28222 1/20 0.33
MAPT P10636 4/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
TSHR P16473 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
POLB P06746 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 1/20 0.30
CA9 Q16790 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
SCHEMBL5409861 0.87 TRPA1 (0.41) TRPA1ATMALDH1A1HTR1BMAPT
SCHEMBL447683 0.79 TRPA1 (0.41) TRPA1ATMALDH1A1HTR1BMAPT
SCHEMBL18315768 0.77 TRPA1 (0.39) TRPA1ATMALDH1A1HTR1BMAPT
SCHEMBL2175294 0.76 TRPA1 (0.48) TRPA1ATMALDH1A1MAPTCYP1A2
SCHEMBL1894227 0.75 TRPA1 (0.38) TRPA1ATMALDH1A1HTR1BMAPT
SCHEMBL5954109 0.74 TRPA1 (0.39) TRPA1ATMALDH1A1MAPTCYP1A2
SCHEMBL17865480 0.73 TRPA1 (0.37) TRPA1ATMALDH1A1HTR1BMAPT
SCHEMBL707653 0.73 PTPN1 (0.41) TRPA1ATMALDH1A1MAPTCYP1A2
SCHEMBL11278838 0.73 HTR1B (0.35) TRPA1ATMHTR1BMAPTLMNA
SCHEMBL11799546 0.73 TRPA1 (0.38) TRPA1ATMALDH1A1MAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2125834-A1 METHOD FOR THE PRODUCTION OF POLYMERISABLE SILICONES Wacker Chemie AG (DE) 2009-12-02 EP disclosed
EP-2125833-A1 METHOD FOR THE PRODUCTION OF POLYMERISABLE SILICONES Wacker Chemie AG (DE) 2009-12-02 EP disclosed
WO-2008090013-A1 METHOD FOR THE PRODUCTION OF POLYMERISABLE SILICONES WACKER CHEMIE AG (DE) 2008-07-31 WO disclosed
WO-2008090012-A1 METHOD FOR THE PRODUCTION OF POLYMERISABLE SILICONES WACKER CHEMIE AG (DE) 2008-07-31 WO disclosed