SCHEMBL2365232

SCHEMBL2365232

C[SiH](C)Oc1c(Br)cccc1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.38
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL7994314 0.80 CYP1A2 (0.34) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL8138383 0.79 GABRA1 (0.47) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL5090616 0.79 CA2 (0.41) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL28041620 0.78 CA2 (0.38) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL9696405 0.78 CA2 (0.38) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL6771911 0.77 CA2 (0.34) CA2GABRA1GABRB2ALDH1A1
SCHEMBL9696632 0.76 CA2 (0.36) CA2GABRA1GABRB2ALDH1A1TSHR
Bromoethane SCHEMBL27514217 0.76 ALDH1A1 (0.43) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL28777826 0.76 CA2 (0.39) CA2GABRA1GABRB2ALDH1A1TSHR
SCHEMBL28422273 0.75 FEN1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8310998-A None JP disclosed
EP-2348857-B1 NOVEL CYCLIC BENZIMIDAZOLE DERIVATIVES USEFUL ANTI-DIABETIC AGENTS MERCK SHARP & DOHME (US) 2016-02-24 EP disclosed
US-8410284-B2 Cyclic benzimidazole derivatives useful as anti-diabetic agents MERCK SHARP & DOHME CORP (US) 2013-04-02 US disclosed
US-20110263533-A1 NOVEL CYCLIC BENZIMIDAZOLE DERIVATIVES USEFUL AS ANTI-DIABETIC AGENTS MERCK SHARP & DOHME CORP. 2011-10-27 US disclosed
EP-2348857-A1 NOVEL CYCLIC BENZIMIDAZOLE DERIVATIVES USEFUL ANTI-DIABETIC AGENTS Merck Sharp & Dohme Corp. (US) 2011-08-03 EP disclosed
WO-2010047982-A1 NOVEL CYCLIC BENZIMIDAZOLE DERIVATIVES USEFUL ANTI-DIABETIC AGENTS MERCK SHARP & DOHME CORP. (US) 2010-04-29 WO disclosed
US-7504392-B2 2,3,4,5-tetrahydro-1H-3-benzazepines and their medical use GLAXO GROUP LIMITED (GB) 2009-03-17 US disclosed
US-20080269197-A1 antipsychotic agents; phenylsulfonyl compounds; 7-Methoxy-8-(3-phenoxy-benzenesulfonyl)-2,3,4,5-tetrahydro-1H-3-benzazepine; schizophrenia GLAXO GROUP LIMITED 2008-10-30 US disclosed
EP-1511727-B1 AROMATIC SULFONES AND THEIR MEDICAL USE GLAXO GROUP LTD (GB) 2007-02-21 EP disclosed
US-20050261279-A1 Compounds GLAXO GROUP LIMITED (GB) 2005-11-24 US disclosed
US-20050176759-A1 7-sulfonyl-3-benzazepine derivatives as modulators of the dopamine receptor and their use for the treatment cns disorders SMITHKLINE BEECHAM P.L.C. (GB) 2005-08-11 US disclosed
EP-1511727-A2 AROMATIC SULFONES AND THEIR MEDICAL USE GLAXO GROUP LIMITED (GB) 2005-03-09 EP disclosed
WO-2003099786-A2 AROMATIC SULFONES AND THEIR MEDICAL USE GLAXO GROUP LIMITED (GB) 2003-12-04 WO disclosed
US-6403522-B1 CONTAINING AN UNSATURATED POLYMER BACKBONE GENERATED BY RING OPENING METATHESIS POLYMERIZATION; MORE RIGID; REACTING A RUTHENIUM OR MOLYBDENUM CARBENE CATALYST WITH A BICYCLIC OLEFIN DEGUSSA AG (DE) 2002-06-11 US disclosed
JP-H08310998-A ANTIFERROELECTRIC LIQUID CRYSTAL COMPOUND AND INTERMEDIATE THEREOF NIPPON SOKEN INC 1996-11-26 JP 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-20110263533-A1 NOVEL CYCLIC BENZIMIDAZOLE DERIVATIVES USEFUL AS ANTI-DIABETIC AGENTS PRKAG2, PRKAG1, PRKAB2 CA2 2472/4885GABRA1 2811/4885GABRB2 1622/4885
US-20080269197-A1 antipsychotic agents; phenylsulfonyl compounds; 7-Methoxy-8-(3-phenoxy-benzenesulfonyl)-2,3,4,5-tetrahydro-1H-3-benzazepine; schizophrenia SIGMAR1, CBR3, CBR1 CA2 1404/4885GABRA1 91/4885GABRB2 169/4885
US-20050261279-A1 Compounds CBR1, CBR3, OXER1 CA2 513/4885GABRA1 1785/4885GABRB2 2194/4885
US-20050176759-A1 7-sulfonyl-3-benzazepine derivatives as modulators of the dopamine receptor and their use for the treatment cns disorders MPL, HTR2B, PDGFRB CA2 4733/4885GABRA1 93/4885GABRB2 53/4885

“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.