SCHEMBL961895

SCHEMBL961895

C=C(C)c1ccccc1CNCCNCCC[Si](C)(OC)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 16/20 0.42
BCHE P06276 5/20 0.42
ACHE P22303 5/20 0.42
CHRM4 P08173 5/20 0.42
CHRM5 P08912 5/20 0.42
CHRM1 P11229 5/20 0.42
CHRM3 P20309 5/20 0.42
GRIN1 Q05586 4/20 0.42
GRIN2A Q12879 4/20 0.42
RECQL P46063 2/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
TSHR P16473 1/20 0.42
THPO P40225 1/20 0.42
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41

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
SCHEMBL962272 0.89 CHRM2 (0.46) CHRM2BCHEACHECHRM4CHRM5
SCHEMBL959975 0.79 CHRM2 (0.43) CHRM2BCHEACHECHRM4CHRM5
SCHEMBL18528574 0.79 CHRM2 (0.43) CHRM2BCHEACHECHRM4CHRM5
SCHEMBL18528528 0.78 CHRM2 (0.42) CHRM2BCHEACHECHRM4CHRM5
SCHEMBL5160165 0.76 CHRM2 (0.56) CHRM2BCHEMEN1MAPTKMT2A
SCHEMBL1705657 0.74 TSHR (0.48) CHRM2CYP2D6TSHRMEN1KMT2A
SCHEMBL2445101 0.72 MAOA (0.56) CHRM2BCHEMEN1MAPTKMT2A
SCHEMBL961897 0.72 SMN1; SMN2 (0.36) GRIN1GRIN2ASMN1; SMN2
SCHEMBL1638782 0.71 CYP2C19 (0.32) TSHRMEN1KMT2A
SCHEMBL10984753 0.70 TSHR (0.39) CHRM2CYP2D6TSHR

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-3125323-A1 SOLAR CELL Fujifilm Corporation (JP) 2017-02-01 EP disclosed
US-20110000658-A1 HYDROPHILIC MEMBER FUJIFILM CORPORATION (JP) 2011-01-06 US disclosed
EP-2239137-A1 HYDROPHILIC MEMBERS FUJIFILM Corporation (JP) 2010-10-13 EP disclosed