SCHEMBL20090041

SCHEMBL20090041

C=CC(=O)NCCC[Si](C)(O[Si](C)(C)O[Si](C)(C)C)O[Si](C)(CCC)O[Si](C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
TGM2 P21980 2/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HPGD P15428 1/20 0.30

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
SCHEMBL20090044 0.93 ZDHHC20 (0.46) ZDHHC20ZDHHC2TGM2GAATSHR
SCHEMBL1285506 0.87 ZDHHC20 (0.51) ZDHHC20ZDHHC2TGM2GAATSHR
SCHEMBL27428987 0.80 ZDHHC20 (0.47) ZDHHC20ZDHHC2TGM2GAATSHR
SCHEMBL13763001 0.79 ZDHHC20 (0.35) ZDHHC20ZDHHC2GAA
SCHEMBL16788734 0.78 ZDHHC20 (0.46) ZDHHC20ZDHHC2TGM2GAATSHR
SCHEMBL20090043 0.76 ZDHHC20 (0.30) ZDHHC20ZDHHC2
SCHEMBL14844645 0.75 ZDHHC20 (0.51) ZDHHC20ZDHHC2TGM2GAATSHR
SCHEMBL307977 0.75 ZDHHC20 (0.51) ZDHHC20ZDHHC2TGM2GAATSHR
SCHEMBL27055198 0.75 ZDHHC20 (0.57) ZDHHC20ZDHHC2TGM2GAATSHR
SCHEMBL20090039 0.74

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
US-20180113237-A1 AMPHIPHILIC BRANCHED POLYDIORGANOSILOXANE MACROMERS ALCON INC. (CH) 2018-04-26 US disclosed