SCHEMBL5346341

SCHEMBL5346341

Fc1cc(F)c(Bc2c(F)cc(F)cc2F)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.35
CES1 P23141 2/20 0.35
ALDH1A1 P00352 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
ERN1 O75460 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.31
TGM2 P21980 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
SCHEMBL6062244 0.87 CES2 (0.38) CES2CES1CA12CA1
SCHEMBL6063538 0.84 CES2 (0.37) CES2CES1
SCHEMBL6063724 0.81 TAAR1 (0.44) ALDH1A1
SCHEMBL6063878 0.79 TRPA1 (0.33)
SCHEMBL6063991 0.79 RAPGEF4 (0.31) CES2CES1RAPGEF4
SCHEMBL6064035 0.79 RAPGEF4 (0.34) RAPGEF4
SCHEMBL6063683 0.79 CES2 (0.33) CES2CES1RAPGEF4
SCHEMBL6063555 0.79 CES2 (0.37) CES2CES1
SCHEMBL6051842 0.78
SCHEMBL6062440 0.76 RAPGEF4 (0.32) RAPGEF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116685594-A Triarylborane catalysts and methods for selective hydrosilylation of esters and lactones using the same 阿尔迪斯化学有限责任公司 2023-09-01 CN claimed
CN-116685594-A Triarylborane catalysts and methods for selective hydrosilylation of esters and lactones using the same 阿尔迪斯化学有限责任公司 2023-09-01 CN disclosed
US-7217676-B2 Hydrophobization and silica for supported catalyst EXXON MOBIL CHEMICAL PATENTS INC. (US) 2007-05-15 US disclosed
US-20060264320-A1 Hydrophobization and silica for supported catalyst RODRIGUEZ GEORGE 2006-11-23 US disclosed
EP-1704171-A2 HYDROPHOBIZATION AND SILICA FOR SUPPORTED CATALYST ExxonMobil Chemical Patents Inc. (US) 2006-09-27 EP disclosed
WO-2005075526-A2 HYDROPHOBIZATION AND SILICA FOR SUPPORTED CATALYST EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-08-18 WO disclosed
US-20050159299-A1 Hydrophobization and silica for supported catalyst EXXONMOBIL CHEMICAL PATENTS INC. 2005-07-21 US disclosed