SCHEMBL9716522

SCHEMBL9716522

CC(O[SiH3])c1ccccc1CCCN

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
TAAR1 Q96RJ0 7/20 0.36
OPRM1 P35372 2/20 0.33
OPRK1 P41145 2/20 0.33
OPRL1 P41146 2/20 0.33
MAOA P21397 1/20 0.32
CYSLTR2 Q9NS75 2/20 0.32
CYSLTR1 Q9Y271 2/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
TLR8 Q9NR97 1/20 0.31
CHRM2 P08172 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL706042 0.85 ADRA2A (0.43) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL3482119 0.83 CYSLTR2 (0.47) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL708783 0.81 ADRA2A (0.51) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL13509766 0.80 TAAR1 (0.41) TAAR1MAOACYSLTR2CYSLTR1HTR2A
SCHEMBL705287 0.77 MAPT (0.39) ADRA2AADRA2BADRA2COPRM1OPRK1
SCHEMBL6699017 0.76 SLC6A2 (0.42) ADRA2ATAAR1MAOAHTR2A
SCHEMBL16541142 0.71 ADRA2C (0.53) ADRA2AADRA2BADRA2C
SCHEMBL705823 0.71 ALOX5 (0.36) ADRA2AADRA2BADRA2CCYSLTR2CYSLTR1
SCHEMBL3678681 0.71 TAAR1 (0.50) TAAR1MAOAHTR2AHRH1
SCHEMBL29943451 0.71 TAAR1 (0.50) TAAR1MAOAHTR2AHRH1

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
EP-0274699-B1 A PROCESS FOR PREPARING ACRYLATE-FUNCTIONAL ORGANOPOLYSILOXANE-URETHANE COPOLYMERS WACKER-CHEMIE GMBH (DE) 1992-07-22 EP disclosed
US-4762887-A Process for preparing acrylate-functional organopolysiloxane-urethane copolymers WACKER SILICONES CORPORATION (US) 1988-08-09 US disclosed
US-4606933-A Acrylate-functional organopolysiloxanes SWS SILICONES CORPORATION (US) 1986-08-19 US disclosed