SCHEMBL8089260

SCHEMBL8089260

CCCCc1nc2c(=O)[nH]ccc2n1Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 4/20 0.49
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
AGTR2 P50052 3/20 0.43
ACHE P22303 1/20 0.42
LMNA P02545 1/20 0.42
AGTR1 P30556 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DHFR P00374 1/20 0.41
TYMS P04818 1/20 0.41

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
SCHEMBL8088471 0.86 AGTR2 (0.53) AGTR2AGTR1
SCHEMBL8089466 0.85 TLR7 (0.52) TLR7AGTR2AGTR1
SCHEMBL8092794 0.83 AGTR2 (0.61) TLR7MEN1KMT2AAGTR2ACHE
SCHEMBL8089387 0.82 AGTR2 (0.62) TLR7AGTR2AGTR1
SCHEMBL9699713 0.81 TLR7 (0.53) TLR7MEN1KMT2AAGTR2AGTR1
SCHEMBL8089312 0.78 AGTR2 (0.55) TLR7AGTR2AGTR1
SCHEMBL8092846 0.76 PPARG (0.59) AGTR2ACHEAGTR1
SCHEMBL8089253 0.76 AGTR2 (0.75) AGTR2AGTR1
SCHEMBL15703662 0.75 TLR7 (0.54) TLR7AGTR2AGTR1
SCHEMBL8092218 0.74 AGTR2 (0.60) AGTR2AGTR1

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
US-6037349-A HAVING ANTAGONISTIC PROPERTIES TOWARDS ANGIOTENSIN II CAN BE USED FOR THE TREATMENT OF HYPERTENSION, ALDOSTERONISM AND CARDIAC INSUFFICIENCY MERCK PATENT GMBH (DE) 2000-03-14 US disclosed
US-5798364-A ANGIOTENSIN II ANTAGONIST, USEFUL FOR TREATMENT OF HYPERTENSION, ALDOSTERONISM AND CARDIAC INSUFFICIENCY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1998-08-25 US disclosed
EP-0505893-A1 Imidazopyridines MERCK PATENT GmbH (DE) 1992-09-30 EP disclosed