SCHEMBL1045006

SCHEMBL1045006

Cc1ccc(-c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.57
HSD11B1 P28845 3/20 0.51
SRD5A2 P31213 1/20 0.51
DPP4 P27487 3/20 0.49
POLB P06746 1/20 0.46
MARS1 P56192 1/20 0.44
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL13906326 0.87 HSD11B1 (0.47) AHRHSD11B1SRD5A2DPP4TP53
SCHEMBL19323001 0.86 HPGD (0.45) AHRTP53
SCHEMBL2933108 0.86 AHR (0.67) AHRHSD11B1SRD5A2MARS1TP53
SCHEMBL13494486 0.83 NOTUM (0.44) HSD11B1DPP4HSP90AB1
SCHEMBL1047205 0.83 TP53 (0.42) AHRHSD11B1DPP4HSP90AB1TP53
SCHEMBL27395925 0.81 NOTUM (0.43) HSD11B1DPP4HSP90AB1
SCHEMBL14202693 0.79 CYP3A4 (0.52) DPP4POLBTP53
SCHEMBL12508331 0.79 GRM2 (0.44) HSD11B1
SCHEMBL26572467 0.79 HSD11B1 (0.46) HSD11B1TP53
SCHEMBL9254409 0.79 AHR (0.59) AHRHSD11B1SRD5A2MARS1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3153501-A1 GLUCAGON ANTAGONISTS Metabasis Therapeutics, Inc. (US) 2017-04-12 EP disclosed
EP-2799428-B1 Glucagon antagonists METABASIS THERAPEUTICS INC (US) 2016-11-16 EP disclosed
US-20150224099-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OTSUKA PHARMA CO LTD (JP) 2015-08-13 US disclosed
US-8987304-B2 Antituberculous composition comprising oxazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-03-24 US disclosed
EP-2799428-A2 Glucagon antagonists Metabasis Therapeutics, Inc. (US) 2014-11-05 EP disclosed
EP-2326618-B1 GLUCAGON ANTAGONISTS METABASIS THERAPEUTICS INC (US) 2014-10-15 EP disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-8114866-B2 Derivatives of 1-piperazine- and 1-homopiperazine-carboxylates, preparation method thereof and use of same as inhibitors of the FAAH enzyme SANOFI-AVENTIS (FR) 2012-02-14 US disclosed
US-8114866-B2 Derivatives of 1-piperazine- and 1-homopiperazine-carboxylates, preparation method thereof and use of same as inhibitors of the FAAH enzyme SANOFI-AVENTIS (FR) 2012-02-14 US disclosed
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP disclosed
US-20070238741-A1 Hypertension, atherosclerosis, restenosis, cerebral ischemia, cerebral vasospasm, or erectile dysfunction; 2-(5-chloro-2-thienyl)-N-(1H-indazol-5-yl)thieno[3,2-d]pyrimidin-4-amine BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-10-11 US disclosed
US-20070238741-A1 Hypertension, atherosclerosis, restenosis, cerebral ischemia, cerebral vasospasm, or erectile dysfunction; 2-(5-chloro-2-thienyl)-N-(1H-indazol-5-yl)thieno[3,2-d]pyrimidin-4-amine BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-10-11 US disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
EP-0126369-B2 PROCESS FOR THE PREPARATION OF HIGH-MOLECULAR POLYARYLENE SULFIDES WHICH MAY BE BRANCHED BAYER AG (DE) 1991-12-18 EP disclosed
EP-0126369-B1 PROCESS FOR THE PREPARATION OF HIGH-MOLECULAR POLYARYLENE SULFIDES WHICH MAY BE BRANCHED BAYER AG (DE) 1988-08-10 EP disclosed
US-4663430-A Process for the preparation of high molecular weight polyarylene sulphide in the absence of water BAYER AKTIENGESELLSCHAFT (DE) 1987-05-05 US disclosed
EP-0126369-A1 Process for the preparation of high-molecular polyarylene sulfides which may be branched BAYER AG (DE) 1984-11-28 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 (3 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-20150224099-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OXA1L, ARG1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 AHR 1203/4885HSD11B1 312/4885SRD5A2 1508/4885
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 AHR 1471/4885HSD11B1 256/4885SRD5A2 167/4885
US-20070238741-A1 Hypertension, atherosclerosis, restenosis, cerebral ischemia, cerebral vasospasm, or erectile dysfunction; 2-(5-chloro-2-thienyl)-N-(1H-indazol-5-yl)thieno[3,2-d]pyrimidin-4-amine CIT, PTGIS, PTGIR AHR 3102/4885HSD11B1 707/4885SRD5A2 230/4885

“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.