SCHEMBL1504701

SCHEMBL1504701

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

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
HTR2A P28223 2/20 0.37
TAAR1 Q96RJ0 1/20 0.37
PGK1 P00558 2/20 0.35
PGK2 P07205 2/20 0.35
DPP4 P27487 2/20 0.35
F2 P00734 1/20 0.35
HRH1 P35367 2/20 0.34
MTOR P42345 1/20 0.34
RAB9A P51151 1/20 0.34
GRM7 Q14831 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
AOC3 Q16853 4/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL8204424 0.80 HTR2A (0.46) TSHRHTR2ATAAR1DPP4F2
SCHEMBL10599884 0.77 TSHR (0.42) TSHRHTR2ATAAR1DPP4F2
SCHEMBL1579897 0.77 CHRNA7 (0.37) PGK1PGK2RAB9ASLC6A3POLB
SCHEMBL1579781 0.76 PGK1 (0.36) TSHRPGK1PGK2
SCHEMBL5413664 0.74 TAAR1 (0.52) TSHRTAAR1AOC3
SCHEMBL6845944 0.74 TSHR (0.39) TSHRHTR2ATAAR1DPP4F2
SCHEMBL9425022 0.74 TSHR (0.55) TSHRHTR2ATAAR1DPP4F2
SCHEMBL22042229 0.74 TSHR (0.55) TSHRHTR2ATAAR1DPP4F2
SCHEMBL2101611 0.73 TSHR (0.37) TSHRHTR2ATAAR1DPP4F2
SCHEMBL138020 0.72 TSHR (0.52) TSHRHTR2ATAAR1DPP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323951-B1 A NOVEL MOLECULAR SIEVE COMPOSITION EMM-13 AND A PROCESS OF USING THE SAME EXXONMOBIL CHEMICAL PATENTS INC (US) 2018-10-31 EP disclosed
EP-2331465-B1 PROCESS OF MAKING ALKYLAROMATICS USING EMM-13 EXXONMOBIL CHEMICAL PATENTS INC (US) 2018-08-29 EP disclosed
US-8704023-B2 Molecular sieve composition EMM-13, a method of making and a process of using the same EXXONMOBIL CHEMICAL PATENTS INC. (US) 2014-04-22 US disclosed
US-8212096-B2 Hydroalkylation of aromatic compounds using EMM-13 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-07-03 US disclosed
US-8198496-B2 Process of making alkylaromatics using EMM-13 EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-06-12 US disclosed
EP-1130630-B1 ABRASIVE COMPOSITION FOR POLISHING LSI DEVICE SHOWA DENKO KK (JP) 2012-05-09 EP disclosed
US-20110166402-A1 Novel Molecular Sieve Composition EMM-13, A Method of Making and a Process of Using the Same EXXONMOBIL CHEMICAL PATENTS INC. 2011-07-07 US disclosed
US-20110144401-A1 Process of Making Alkylaromatics Using EMM-13 EXXONMOBIL CHEMICAL PATENTS INC. 2011-06-16 US disclosed
EP-2331465-A1 PROCESS OF MAKING ALKYLAROMATICS USING EMM-13 ExxonMobil Chemical Patents Inc. (US) 2011-06-15 EP disclosed
EP-2323951-A1 A NOVEL MOLECULAR SIEVE COMPOSITION EMM-13, A METHOD OF MAKING AND A PROCESS OF USING THE SAME ExxonMobil Chemical Patents Inc. (US) 2011-05-25 EP disclosed
US-20020017064-A1 LSI device polishing composition and method for reproducing LSI device SHOWA DENKO K.K. (JP) 2002-02-14 US disclosed
US-6346498-B1 PERMEATING METAL INTO MOLECULAR SIEVE; IN SITU SELECTIVATION WITH SILICON COMPOUND AND ROASTING; BY-PRODUCT INHIBITION EXXONMOBIL OIL CORPORATION 2002-02-12 US disclosed
US-20010051754-A1 PLURAL STAGE TOLUENE DISPROPORTIONATION PROCESS MINIMIZING ETHYLBENZENE MOBIL OIL CORPORATION 2001-12-13 US disclosed
US-6299659-B1 POLISHING MATERIAL COMPOSITION FOR POLISHING LSI DEVICES COMPRISING WATER AND CERIUM OXIDE WHICH HAS BEEN SURFACE TREATED WITH COUPLING AGENT TO IMPROVE AFFINITY FOR PADS SHOWA DENKO K.K. (JP) 2001-10-09 US disclosed
EP-1130630-A1 ABRASIVE COMPOSITION FOR POLISHING LSI DEVICE Showa Denko Kabushiki Kaisha (JP) 2001-09-05 EP disclosed
US-6207871-B1 CONVERTING A HYDROCARBON FEEDSTREAM COMPRISING ETHYLBENZENE AND META-XYLENE OVER MOLECULAR SIEVE CATALYST UNDER ETHYLBENZENE CONVERSION CONDITIONS, MOBIL OIL CORPORATION 2001-03-27 US disclosed
WO-2001009067-A1 PLURAL STAGE TOLUENE DISPROPORTIONATION PROCESS MINIMIZING ETHYLBENZENE PRODUCTION MOBIL OIL CORPORATION (US) 2001-02-08 WO disclosed
US-4532368-A Passing mixture of phenol, ortho-alkylphenol, alkylating agent through zeolite catalyst, separating and recycling ortho-alkylphenols ETHYL CORPORATION (US) 1985-07-30 US disclosed
US-4444989-A Methylation of toluene to para-xylene catalyzed by crystalline silica E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-04-24 US disclosed
US-4283306-A CATALYTIC METHYLATION OF TOLUENE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-08-11 US 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 (2 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-20110166402-A1 Novel Molecular Sieve Composition EMM-13, A Method of Making and a Process of Using the Same EPCAM, CA13, SEC13 TSHR 3958/4885HTR2A 4512/4885TAAR1 4827/4885
US-20110144401-A1 Process of Making Alkylaromatics Using EMM-13 ALKBH3, ETV6, ALK TSHR 4241/4885HTR2A 3994/4885TAAR1 4041/4885

“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.