SCHEMBL7023232

SCHEMBL7023232

C=CCOC(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.C=COC(=O)NCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 3/20 0.34
BRD4 O60885 2/20 0.34
ACHE P22303 8/20 0.33
HRH4 Q9H3N8 2/20 0.33
HRH3 Q9Y5N1 2/20 0.33
TSHR P16473 1/20 0.31

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
SCHEMBL35366 0.93 ACHE (0.38) ERN1BRD4ACHEHRH4HRH3
SCHEMBL35590 0.90 ACHE (0.33) ACHE
SCHEMBL1286118 0.82 ACHE (0.38) ERN1BRD4ACHEHRH4HRH3
SCHEMBL13288287 0.81
SCHEMBL812405 0.79 ACHE (0.33) ACHE
SCHEMBL810665 0.79 ACHE (0.33) ACHE
SCHEMBL7090002 0.79 BRD4 (0.42) ERN1BRD4ACHEHRH4HRH3
SCHEMBL8679303 0.78
SCHEMBL8763776 0.77 ACHE (0.46) ACHEHRH4HRH3TSHR
SCHEMBL20608972 0.75 EPHX1 (0.38) ACHETSHR

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-1019416-B1 LOW WATER POLYMERIC SILICONE COMPOSITIONS HAVING REDUCED MODULUS BAUSCH & LOMB (US) 2003-01-22 EP disclosed
EP-1019416-A1 MONOMERIC UNITS USEFUL FOR REDUCING THE MODULUS OF LOW WATER POLYMERIC SILICONE COMPOSITIONS BAUSCH & LOMB INCORPORATED (US) 2000-07-19 EP disclosed
WO-1997020851-A1 MONOMERIC UNITS USEFUL FOR REDUCING THE MODULUS OF LOW WATER POLYMERIC SILICONE COMPOSITIONS BAUSCH & LOMB INCORPORATED (US) 1997-06-12 WO disclosed