SCHEMBL21734385

SCHEMBL21734385

C=CC(=O)NC[Si](C)(C)C(C)(C)OC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
TGM2 P21980 2/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL24024036 0.81 ALDH1A1 (0.36) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL21734442 0.75 ALDH1A1 (0.52) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL5321292 0.74 TSHR (0.46) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL5324563 0.74 TSHR (0.46) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL448048 0.73 ALDH1A1 (0.54) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL3138226 0.72 TSHR (0.48) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL24024115 0.72
SCHEMBL24492184 0.71 TSHR (0.46) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL9858498 0.68 TSHR (0.48) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL6067443 0.68 TSHR (0.43) ALDH1A1TSHRMAPK1TDP1ZDHHC20

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
WO-2020036022-A1 ORGANOPOLYSILOXANE COMPOUND, METHOD FOR PRODUCING SAME, AND ANTISTATIC AGENT AND CURABLE COMPOSITION, EACH OF WHICH CONTAINS SAME 信越化学工業株式会社 2020-02-20 WO disclosed