SCHEMBL28019331

SCHEMBL28019331

CCCC[Si](C)(C)OCc1cccc(CCl)c1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
ALDH1A1 P00352 1/20 0.32
DRD2 P14416 3/20 0.32
OPRM1 P35372 3/20 0.32
DRD3 P35462 3/20 0.32
OPRD1 P41143 3/20 0.32
OPRK1 P41145 3/20 0.32
TSHR P16473 1/20 0.32
MRGPRX4 Q96LA9 1/20 0.31
BCHE P06276 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
SCHEMBL16062468 0.82 IDO1 (0.47)
SCHEMBL15687564 0.73 IDO1 (0.36) TSHR
SCHEMBL926557 0.72 LPL (0.35)
SCHEMBL9033202 0.71 IDO1 (0.41)
SCHEMBL9549828 0.71 MAPT (0.46) ALDH1A1DRD3TSHR
SCHEMBL3631052 0.71 IDO1 (0.41) ALDH1A1
SCHEMBL30190420 0.71 ESR1 (0.31) ALDH1A1
SCHEMBL7421540 0.71
SCHEMBL23794950 0.71 LPL (0.49)
SCHEMBL30861915 0.71 LPL (0.49)

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-104837816-A GPR40 receptor agonist, method for preparing same, and pharmaceutical composition containing same as active ingredient LG LIFE SCIENCES LTD 2015-08-12 CN disclosed