SCHEMBL1314801

SCHEMBL1314801

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

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPT P10636 1/20 0.31
TAAR1 Q96RJ0 2/20 0.30
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30
SLC6A2 P23975 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
SCHEMBL10630507 0.79 MAPK1 (0.38) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL20955812 0.78 MAPK1 (0.37) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL450654 0.77 TAAR1 (0.36) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL708403 0.77 ESR1 (0.34) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL4241 0.77 ESR1 (0.34) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL9815122 0.76 ESR1 (0.35) ESR1ESR2NR1H2NR1H3MAPK1
SCHEMBL6391397 0.75 ESR1 (0.33) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL988384 0.74 NR1H2 (0.48) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL6013056 0.74 ESR1 (0.41) ESR1ESR2NR1H2NR1H3TSHR
SCHEMBL15889153 0.74 ESR1 (0.41) ESR1ESR2NR1H2NR1H3TSHR

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9919300-B2 1-hexene production process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-20 US disclosed
EP-2484685-B1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-11-01 EP disclosed
US-20170036200-A1 1-HEXENE PRODUCTION PROCESS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-09 US disclosed
US-20150105572-A1 TRANSITION METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-16 US disclosed
US-20150105237-A1 CATALYTIC COMPONENT FOR TRIMERIZATION AND TRIMERIZATION CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-16 US disclosed
EP-2691357-A1 METHOD FOR PRODUCING 1-HEXENE Sumitomo Chemical Company Limited (JP) 2014-02-05 EP disclosed
US-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-09 US disclosed
WO-2012133936-A1 CATALYST FOR PRODUCING ETHYLENE-BASED POLYMER AND METHOD FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 WO disclosed
WO-2012133928-A1 TRIMERIZATION CATALYST AND METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 WO disclosed
WO-2012133929-A1 METHOD FOR PRODUCING THE TRANSITION METAL ION COMPLEX, CATALYST FOR TRIMERIZATION, AND METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-04 WO disclosed
EP-0980870-A1 Process for preparing silanes substituted at position alpha of the silicon atom by a tertiary hydrocarbon group Wacker-Chemie GmbH (DE) 2000-02-23 EP disclosed
EP-0963992-A2 Method for preparation of tertiary-hydrocarbylsilyl compounds DOW CORNING CORPORATION (US) 1999-12-15 EP disclosed
US-5872274-A Method for preparation of tertiary-hydrocarbylsilyl compounds DOW CORNING CORPORATION (US) 1999-02-16 US disclosed
EP-0405560-B2 Preparation of tertiary-hydrocarbylsilyl compounds DOW CORNING TORAY SILICONE (JP) 1998-08-12 EP disclosed
US-5068386-A PREPARATION OF TERTIARY-HYDROCARBYLSILYL COMPOUNDS DOW CORNING TORAY SILICONE COMPANY, LTD. (JP) 1991-11-26 US disclosed
US-5061817-A ENOLSILYL ETHER COMPOUND KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1991-10-29 US disclosed
EP-0405560-A2 Preparation of tertiary-hydrocarbylsilyl compounds Dow Corning Toray Silicone Company, Limited (JP) 1991-01-02 EP disclosed
EP-0167155-B1 BETA-LACTAM COMPOUND AND PREPARING THEREOF KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-03-08 EP disclosed
US-4791198-A CHEMICAL INTERMEDIATES FOR THIENAMYCINS KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1988-12-13 US disclosed
EP-0167155-A1 beta-Lactam compound and preparing thereof KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1986-01-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170036200-A1 1-HEXENE PRODUCTION PROCESS AP1M1, HK1, CYC1 ESR1 84/4885ESR2 207/4885NR1H2 2092/4885
US-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE AP2A1, AP1M1, ME1 ESR1 452/4885ESR2 641/4885NR1H2 3463/4885
US-20150105572-A1 TRANSITION METAL COMPLEX AP1M1, AP3M1, EMC1 ESR1 30/4885ESR2 216/4885NR1H2 2499/4885
US-20150105237-A1 CATALYTIC COMPONENT FOR TRIMERIZATION AND TRIMERIZATION CATALYST AP1M1, AMY1A, AP3M1 ESR1 66/4885ESR2 300/4885NR1H2 1516/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.