SCHEMBL11059699

SCHEMBL11059699

C=C(C)C(=O)OCCC[Si](OCCOC)(OCCOC)OCCOC.C=CC(=O)OCCC[Si](OC)(OC)OC

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.40
HPGD P15428 1/20 0.40
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 1/20 0.40
TP53 P04637 2/20 0.33
HIF1A Q16665 2/20 0.33
THRB P10828 2/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL9655071 0.91 TSHR (0.45) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL5448469 0.91 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL424597 0.89 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5080728 0.89 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28882901 0.89 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL73425 0.87 TSHR (0.49) TSHRALDH1A1THRBPOLBAPEX1
SCHEMBL230537 0.87 TSHR (0.52) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL11030313 0.87 TSHR (0.42) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL28246671 0.86 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL5971626 0.86 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4TP53

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-4440907-A Process of producing a water-curable, silane modified alkylene-alkyl acrylate copolymer by reacting an alkylene-alkyl acrylate copolymer with a polysiloxane predispersed in a thermoplastic resin matrix UNION CARBIDE CORPORATION (US) 1984-04-03 US disclosed