SCHEMBL9030299

SCHEMBL9030299

C=Cc1nc(CCC)n(Cc2ccc(-c3ccccc3-c3nnn[nH]3)cc2)c1C=O

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 8/20 0.56
AGTR1 P30556 8/20 0.54
GP6 Q9HCN6 1/20 0.51

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
SCHEMBL976 0.90 GP6 (0.64) AGTR2AGTR1GP6
SCHEMBL9284101 0.89 AGTR2 (0.55) AGTR2AGTR1GP6
SCHEMBL9198036 0.89 AGTR2 (0.58) AGTR2AGTR1GP6
SCHEMBL7362569 0.88 AGTR2 (0.72) AGTR2AGTR1GP6
SCHEMBL9205340 0.86 AGTR2 (0.73) AGTR2AGTR1GP6
SCHEMBL39 0.86 AGTR2 (0.54) AGTR2AGTR1GP6
SCHEMBL8265399 0.86 AGTR2 (0.55) AGTR2AGTR1GP6
SCHEMBL9595906 0.85 AGTR2 (0.61) AGTR2AGTR1GP6
SCHEMBL860 0.84 GP6 (0.72) AGTR2AGTR1GP6
SCHEMBL9031013 0.84 AGTR2 (0.57) AGTR2AGTR1GP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0479903-B1 SUBSTITUTED IMIDAZOLES USEFUL AS ANGIOTENSIN II BLOCKERS DU PONT (US) 1996-02-21 EP disclosed
US-5354867-A Hypertensive agents; congestive heart failure; used with diuretics to enhance activity; used with NSAIDs to prevent renal failure E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-10-11 US disclosed
WO-1991000277-A1 SUBSTITUTED IMIDAZOLES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-01-10 WO disclosed