SCHEMBL7543816

SCHEMBL7543816

COC(=O)c1ccc(O[Si](C)(C)C)cc1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.64
CA2 P00918 2/20 0.64
MAPT P10636 7/20 0.58
TDP1 Q9NUW8 1/20 0.55
CA12 O43570 1/20 0.55
CA7 P43166 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
STS P08842 1/20 0.53
TSHR P16473 1/20 0.52
KMT2A Q03164 5/20 0.51
RAB9A P51151 4/20 0.51
MEN1 O00255 4/20 0.51
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 1/20 0.50
NPC1 O15118 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
POLB P06746 1/20 0.49
LOXL2 Q9Y4K0 1/20 0.48

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
SCHEMBL8906116 0.82 CA1 (0.56) CA1CA2MAPTTDP1CA12
SCHEMBL9339181 0.81 ELANE (0.53) MAPTSTSKMT2ARAB9AMEN1
SCHEMBL23600 0.80 CA1 (0.80) CA1CA2MAPTTDP1CA12
SCHEMBL28993944 0.80 CA1 (0.80) CA1CA2MAPTTDP1CA12
SCHEMBL7539404 0.79 CA12 (0.59) CA1CA2TDP1CA12CA7
SCHEMBL18985150 0.79 CA1 (0.58) CA1CA2MAPTTDP1CA12
SCHEMBL24684839 0.79 CA1 (0.69) CA1CA2MAPTTDP1CA12
SCHEMBL8831777 0.79 MAPT (0.61) MAPTSTSTSHRKMT2ARAB9A
Methyl 4-Methoxybenzoate SCHEMBL231243 0.79 CA1 (1.00) CA1CA2MAPTTDP1CA12
SCHEMBL69218 0.79 CA1 (0.75) CA1CA2MAPTTDP1CA12

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
EP-1205482-A2 Alkyl trimethylsiloxybenzoat compounds and method of preparation Clariant Life Science Molecules (Florida) Inc. (US) 2002-05-15 EP disclosed