SCHEMBL6513407

SCHEMBL6513407

C=C(C)[Si](C)(Cl)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
NR1H2 P55055 2/20 0.37
NR1H3 Q13133 2/20 0.37
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.35
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
PAX8 Q06710 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NR5A2 O00482 1/20 0.30
NR5A1 Q13285 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
SCHEMBL22200088 0.78 ESR1 (0.39) ESR1ESR2NR1H2NR1H3MAPT
SCHEMBL7900984 0.76 ESR1 (0.43) ESR1ESR2NR1H2NR1H3MAPT
SCHEMBL9652309 0.73 ESR1 (0.39) ESR1ESR2NR1H2NR1H3MAPT
SCHEMBL1316779 0.72 MAPT (0.41) ESR1ESR2NR1H2NR1H3MAPT
SCHEMBL1313157 0.70 MAPT (0.38) ESR1ESR2MAPTHPGDCES2
SCHEMBL1314057 0.70 MAPT (0.38) ESR1ESR2MAPTHPGDCES2
SCHEMBL5709835 0.70 MAPT (0.38) ESR1ESR2MAPTHPGDCES2
SCHEMBL144807 0.69 ESR1 (0.44) ESR1ESR2NR1H2NR1H3MAPT
SCHEMBL197544 0.69 ESR1 (0.44) ESR1ESR2NR1H2NR1H3MAPT
SCHEMBL68909 0.69 ESR1 (0.44) ESR1ESR2NR1H2NR1H3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050124747-A1 Coating composition for ink-jet recording medium and ink-jet recording medium DEUTSCHE BANK AG, NEW YORK BRANCH, AS COLLATERAL AGENT 2005-06-09 US disclosed
EP-1470928-A1 COATING COMPOSITION FOR INK-JET RECORDING MEDIUM AND INK-JET RECORDING MEDIUM Clariant International Ltd. (CH) 2004-10-27 EP disclosed
EP-1114734-A1 RESIN COMPOSITION FOR INK-JET RECORDING SHEET AND RECORDING SHEET MADE WITH THE SAME DAICEL CHEMICAL INDUSTRIES, Ltd. (JP) 2001-07-11 EP disclosed
EP-0989162-A1 THERMOPLASTIC RESIN COMPOSITION, WATER-BASED COMPOSITION, HEAT-SENSITIVE PRESSURE-SENSITIVE ADHESIVE, AND HEAT-SENSITIVE SHEET Daicel Chemical Industries, Ltd. (JP) 2000-03-29 EP disclosed
EP-0989168-A1 Water-based coating composition Daicel Chemical Industries, Ltd. (JP) 2000-03-29 EP disclosed