SCHEMBL9460946

SCHEMBL9460946

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

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 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
SCHEMBL12571490 0.81
SCHEMBL1701907 0.78
SCHEMBL13411366 0.75
SCHEMBL10660072 0.75
SCHEMBL124325 0.74 OPRM1 (0.35) ALDH1A1
SCHEMBL17016727 0.73 TRPV1 (0.31) ALDH1A1
SCHEMBL17131451 0.73 TRPV1 (0.31) ALDH1A1
SCHEMBL17016728 0.73 TRPV1 (0.31) ALDH1A1
SCHEMBL9359638 0.72 TSHR (0.35) ALDH1A1TSHRTDP1
SCHEMBL8206007 0.70

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-0294525-B1 HYDROXYL-FUNCTIONAL DISILOXANES AND POLYSILOXANE OLIGOMERS Th. Goldschmidt AG (DE) 1993-02-17 EP disclosed
EP-0294525-A1 Hydroxyl-functional disiloxanes and polysiloxane oligomers Th. Goldschmidt AG (DE) 1988-12-14 EP disclosed
US-4689383-A Hydroxyl-functional disiloxanes and polysiloxane oligomers THORATEC LABORATORIES CORP. (US) 1987-08-25 US disclosed