SCHEMBL22200088

SCHEMBL22200088

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
HPGD P15428 1/20 0.39
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 0.36
MAPT P10636 2/20 0.35
PAX8 Q06710 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NOS3 P29474 2/20 0.32
NOS1 P29475 2/20 0.32
TP53 P04637 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 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
SCHEMBL9652309 0.79 ESR1 (0.39) ESR1ESR2HPGDCES2CES1
SCHEMBL6513407 0.78 ESR1 (0.40) ESR1ESR2HPGDCES2CES1
SCHEMBL7900984 0.77 ESR1 (0.43) ESR1ESR2HPGDCES2CES1
SCHEMBL1130961 0.74 CES2 (0.48) ESR1ESR2HPGDCES2CES1
SCHEMBL9118568 0.70 PAX8 (0.34) ESR1ESR2HPGDCES2CES1
SCHEMBL5146804 0.70 HPGD (0.36) ESR1ESR2HPGDCES2CES1
SCHEMBL23521415 0.69 PAX8 (0.36) ESR1ESR2HPGDCES2CES1
SCHEMBL3244338 0.69 PAX8 (0.36) ESR1ESR2HPGDCES2CES1
SCHEMBL22200151 0.69 MAPT (0.40) ESR1ESR2HPGDCES2CES1
SCHEMBL679391 0.69 PAX8 (0.36) ESR1ESR2HPGDCES2CES1

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
US-20230387464-A1 Nonaqueous Electrolytic Solution and Nonaqueous Electrolytic Solution Battery MU IONIC SOLUTIONS CORPORATION (JP) 2023-11-30 US disclosed
EP-3686983-A1 NONAQUEOUS ELECTROLYTE, NONAQUEOUS ELECTROLYTE SECONDARY BATTERY, AND ENERGY DEVICE Mitsubishi Chemical Corporation (JP) 2020-07-29 EP disclosed
US-20200220222-A1 NONAQUEOUS ELECTROLYTE, NONAQUEOUS ELECTROLYTE SECONDARY BATTERY, AND ENERGY DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2020-07-09 US disclosed