SCHEMBL8999634

SCHEMBL8999634

CCCCCC[C@H](C(=O)O)n1cnc([N+](=O)[O-])c1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.48
AGTR2 P50052 1/20 0.48

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
SCHEMBL8999603 1.00 AGTR1 (0.48) AGTR1AGTR2
SCHEMBL8999688 0.99 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL8999683 0.87 L3MBTL1 (0.42) AGTR1AGTR2
SCHEMBL8999689 0.87 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL8999691 0.87 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL8999769 0.86 AGTR1 (0.39) AGTR1AGTR2
SCHEMBL8999604 0.85 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL8999780 0.83 L3MBTL1 (0.34) AGTR1AGTR2
SCHEMBL8999710 0.81 AGTR1 (0.36) AGTR1AGTR2
SCHEMBL8999799 0.81 AGTR1 (0.35) AGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5380866-A Alkyl substituted nitroimidazole acetic acids ELI LILLY AND COMPANY (US) 1995-01-10 US claimed
EP-0621269-A1 Alkyl substituted nitroimidazole acetic acids ELI LILLY AND COMPANY (US) 1994-10-26 EP claimed
JP-6329638-A None JP disclosed
US-5484780-A CARDIOVASCULAR, HYPOTENSIVE ELI LILLY AND COMPANY (US) 1996-01-16 US disclosed
US-5401851-A Preparation of proline derivatives ELI LILLY AND COMPANY (US) 1995-03-28 US disclosed
US-5380866-A Alkyl substituted nitroimidazole acetic acids ELI LILLY AND COMPANY (US) 1995-01-10 US disclosed
JP-H06329638-A ALKYL SUBSTITUTED NITROIMIDAZOLE ACETIC ACID ELI LILLY & CO 1994-11-29 JP disclosed
EP-0621269-A1 Alkyl substituted nitroimidazole acetic acids ELI LILLY AND COMPANY (US) 1994-10-26 EP disclosed
US-5344937-A Alkyl substituted nitroimidazole acetic acids ELI LILLY AND COMPANY (US) 1994-09-06 US disclosed
EP-0573271-A1 Angiotensin II antagonists ELI LILLY AND COMPANY (US) 1993-12-08 EP disclosed