SCHEMBL2575653

SCHEMBL2575653

C=C[Si](C)(C)c1ccc2cc([Si](C)(C)C=C)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 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
SCHEMBL678612 0.82 NR1H2 (0.59) NR1H2NR1H3
SCHEMBL5772639 0.78 NR1H2 (0.42) NR1H2NR1H3
SCHEMBL20972931 0.76 NR1H2 (0.43) NR1H2NR1H3
SCHEMBL8083285 0.75
SCHEMBL2579803 0.75 NR1H2 (0.53) NR1H2NR1H3
SCHEMBL22041208 0.74 NR1H2 (0.48) NR1H2NR1H3
SCHEMBL3378809 0.73 NR1H2 (0.52) NR1H2NR1H3CYP2A6
SCHEMBL3381733 0.73 CA1 (0.48) NR1H2NR1H3CYP1A2CYP2A6
SCHEMBL10324259 0.71 NR1H2 (0.50) NR1H2NR1H3
SCHEMBL3378627 0.71 NR1H2 (0.50) NR1H2NR1H3CYP2A6

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8048977-B2 Organosilicon polymers E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-11-01 US claimed
US-20090069525-A1 ORGANOSILICON POLYMERS E. I. DU PONT DE NEMOURS AND COMPANY 2009-03-12 US claimed
WO-2007130014-A1 ORGANOSILICON POLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-11-15 WO claimed
US-8048977-B2 Organosilicon polymers E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-11-01 US disclosed
US-20090069525-A1 ORGANOSILICON POLYMERS E. I. DU PONT DE NEMOURS AND COMPANY 2009-03-12 US disclosed
WO-2007130014-A1 ORGANOSILICON POLYMERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-11-15 WO disclosed