SCHEMBL1047205

SCHEMBL1047205

Cc1ccc(-c2cc(Cl)ccc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AHR P35869 2/20 0.42
HTR2B P41595 1/20 0.41
PDE4D Q08499 1/20 0.41
PRKAB2 O43741 1/20 0.41
PRKAG1 P54619 1/20 0.41
PRKAA2 P54646 1/20 0.41
PRKAA1 Q13131 1/20 0.41
PRKAG3 Q9UGI9 1/20 0.41
PRKAG2 Q9UGJ0 1/20 0.41
PRKAB1 Q9Y478 1/20 0.41
MEN1 O00255 1/20 0.40

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
SCHEMBL21020816 0.86 ALKBH3 (0.49) KDM4EALDH1A1HPGDAHRPRKAB2
SCHEMBL2473835 0.86 AHR (0.54) TP53ALDH1A1LMNAAHRHTR2B
SCHEMBL10389844 0.83 MAP4K4 (0.47) KDM4EALDH1A1LMNAHPGDNFKB1
SCHEMBL1045006 0.83 AHR (0.57) TP53AHRHSP90AB1HSD11B1DPP4
SCHEMBL7870739 0.81 PTGS2 (0.44) KDM4EALDH1A1LMNAHPGDNFKB1
SCHEMBL20241915 0.79 BACE1 (0.53) KDM4EALDH1A1LMNAHPGDMEN1
SCHEMBL9257913 0.79 PRKAB2 (0.43) TP53LMNAAHRHTR2BPDE4D
SCHEMBL21021252 0.79 PLA2G7 (0.50) TP53KDM4EALDH1A1NFKB1NFKB2
SCHEMBL12999476 0.79 ABL1 (0.47) KDM4EALDH1A1HPGDSMN1; SMN2AHR
SCHEMBL13494486 0.78 NOTUM (0.44) KDM4EALDH1A1LMNAHPGDNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20120135997-A1 PHARMACEUTICAL COMPOSITION COMPRISING A LACTAM OR BENZENESULFONAMIDE COMPOUND SHIONOGI & CO., LTD. (JP) 2012-05-31 US disclosed
WO-2012065958-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2012-05-24 WO disclosed
US-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY NOVARTIS AG (CH) 2012-05-17 US disclosed
EP-2269694-A2 Antituberculous composition comprising oxazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-01-05 EP disclosed
WO-2010136474-A2 SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS NOVARTIS AG (CH) 2010-12-02 WO disclosed
US-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors NOVARTIS AG (CH) 2010-12-02 US disclosed
US-20090275528-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-11-05 US disclosed
EP-1931425-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-06-18 EP disclosed
EP-0087045-A1 Process for preparing polyarylenesulphides with increased thermal and chemical resistance and improved quality of colour BAYER AG (DE) 1983-08-31 EP disclosed
EP-0087046-A1 Process for preparing polyarylenesulphides with increased thermal and chemical resistance BAYER AG (DE) 1983-08-31 EP disclosed
EP-0023314-B1 PROCESS FOR PREPARING POLY(ARYLENE SULFIDES) BAYER AG (DE) 1983-07-20 EP disclosed
US-4362864-A Process for the preparation of polyarylene sulphides BAYER AKTIENGESELLSCHAFT (DE) 1982-12-07 US disclosed
EP-0065689-A1 Method of producing poly(arylene sulfides) BAYER AG (DE) 1982-12-01 EP disclosed
US-4331801-A Process for the preparation of polyarylene sulphides BAYER AKTIENGESELLSCHAFT (DE) 1982-05-25 US disclosed
EP-0040747-A2 Process for preparing polyarylene sulfides BAYER AG (DE) 1981-12-02 EP disclosed
US-4303781-A Process for the preparation of polyarylene sulphides BAYER AKTIENGESELLSCHAFT (DE) 1981-12-01 US disclosed
EP-0023313-A1 Process for preparing poly(arylene sulfides) BAYER AG (DE) 1981-02-04 EP disclosed
EP-0023314-A1 Process for preparing poly(arylene sulfides) BAYER AG (DE) 1981-02-04 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 (5 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 TP53 4052/4885KDM4E 2723/4885ALDH1A1 704/4885
US-20120135997-A1 PHARMACEUTICAL COMPOSITION COMPRISING A LACTAM OR BENZENESULFONAMIDE COMPOUND BACE1, STS, APP TP53 1288/4885KDM4E 2337/4885ALDH1A1 3654/4885
US-20090275528-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OXA1L, ARG1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 TP53 4052/4885KDM4E 2723/4885ALDH1A1 704/4885
US-20100305131-A1 Substituted Aminopropionic Derivatives as Neprilysin inhibitors MME, AGTR1, REN TP53 4286/4885KDM4E 2452/4885ALDH1A1 852/4885
US-20120122844-A1 METHOD OF TREATING CONTRAST-INDUCED NEPHROPATHY REN, SERPINB1, MME TP53 4285/4885KDM4E 3817/4885ALDH1A1 2474/4885

“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.