SCHEMBL456

SCHEMBL456

COCCc1ncc(CO)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRS3 P32247 10/20 0.38
HCAR2 Q8TDS4 1/20 0.36
MMP2 P08253 1/20 0.35
CBFB Q13951 1/20 0.33
CACNA1H O95180 1/20 0.33
HTR1B P28222 2/20 0.33
MTOR P42345 1/20 0.33
HRH1 P35367 1/20 0.32
PKM P14618 1/20 0.31

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
Hydrochloric Acid SCHEMBL8115870 0.80 CACNA1H (0.33) BRS3HCAR2MMP2CACNA1HHTR1B
SCHEMBL9425091 0.79 BRS3 (0.38) BRS3HTR1BMTORHRH1PKM
SCHEMBL23367694 0.77 CACNA1H (0.35) HCAR2MMP2CACNA1HHRH1
SCHEMBL810902 0.76 BRS3 (0.47) BRS3
SCHEMBL15893925 0.76 CACNA1H (0.34) HCAR2MMP2CACNA1H
SCHEMBL14012154 0.73 TSHR (0.38) BRS3HTR1BMTORPKM
SCHEMBL14333827 0.71 HCAR2 (0.34) HCAR2MMP2CACNA1H
Hydrochloric Acid SCHEMBL8122337 0.70 DAO (0.35) BRS3MMP2HTR1BMTOR
SCHEMBL14037799 0.70
SCHEMBL5791952 0.69 MAPK1 (0.31) BRS3PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733366-B1 Pharmaceutical compositions comprising angiotensin II receptor blocking imidazoles and diuretics DU PONT (US) 1998-04-01 EP disclosed
EP-0324377-B1 Angiotensin II receptor blocking imidazoles and combinations thereof with diuretics and NSaids DU PONT (US) 1997-04-16 EP disclosed
EP-0733366-A2 Pharmaceutical compositions comprising angiotensin II receptor blocking imidazoles and diuretics E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-09-25 EP disclosed
EP-0253310-B1 Angiotensin II receptor blocking imidazoles DU PONT (US) 1994-10-26 EP disclosed
US-5155118-A Administering angiotensin inhibitor E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-13 US disclosed
US-5153197-A Treatment of hypertension with angiotensin II blocking imidazoles E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-06 US disclosed
US-5138069-A Treating hypertension and congestive heart failure E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-11 US disclosed
US-5128355-A Hypotensive E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-07-07 US disclosed
EP-0324377-A2 Angiotensin II receptor blocking imidazoles and combinations thereof with diuretics and NSaids E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-07-19 EP disclosed
WO-1989006233-A1 ANGIOTENSIN II RECEPTOR BLOCKING IMIDAZOLES AND COMBINATIONS THEREOF WITH DIURETICS AND NSAIDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-07-13 WO disclosed
EP-0253310-A2 Angiotensin II receptor blocking imidazoles E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-01-20 EP disclosed