SCHEMBL28118715

SCHEMBL28118715

CO[Si](CCc1ccccc1)(OC)OC(C)N

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.40
TAAR1 Q96RJ0 2/20 0.40
MAOA P21397 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
CYP2A6 P11509 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
HTR2A P28223 1/20 0.38
CYP2D6 P10635 1/20 0.38
AOC3 Q16853 1/20 0.37

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
SCHEMBL28531049 0.84 EPHX1 (0.44) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL106416 0.82 TDP1 (0.46) TAAR1CYP2A6HTR2A
Ethylenediamine SCHEMBL17417251 0.79 HTR2A (0.50) TAAR1MAOACYP2A6HTR2A
SCHEMBL2489519 0.78 MAPT (0.39)
SCHEMBL27424871 0.78 SIGMAR1 (0.38) TAAR1SIGMAR1CYP2A6HTR2ACYP2D6
SCHEMBL1614971 0.77 HTR2A (0.38) TAAR1MAOACYP2A6HTR2ACYP2D6
SCHEMBL105938 0.77 TAAR1 (0.42) SLC6A2TAAR1MAOASLC6A4SLC6A3
SCHEMBL27917139 0.76 VCP (0.32) CYP2D6
SCHEMBL2488885 0.76 HTR2A (0.42) TAAR1MAOACYP2A6HTR2ACYP2D6
SCHEMBL7554332 0.75 TDP1 (0.40) TAAR1SIGMAR1

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-103797065-B Compositions containing vinyl alcohol polymer 株式会社可乐丽 2016-12-14 CN disclosed