SCHEMBL8089262

SCHEMBL8089262

CCCCc1nc2ccn(Cc3ccccc3N)c(=O)c2n1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.71

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 17/20 0.71
AGTR2 P50052 17/20 0.71
PPARG P37231 1/20 0.53

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
SCHEMBL8081242 0.93 AGTR1 (0.66) AGTR1AGTR2PPARG
SCHEMBL8094903 0.92 AGTR1 (0.61) AGTR1AGTR2PPARG
SCHEMBL9133442 0.91 AGTR1 (0.69) AGTR1AGTR2PPARG
SCHEMBL8088469 0.88 AGTR1 (0.59) AGTR1AGTR2PPARG
SCHEMBL8089393 0.88 AGTR1 (0.60) AGTR1AGTR2PPARG
SCHEMBL8089291 0.86 AGTR1 (0.73) AGTR1AGTR2
SCHEMBL8091186 0.85 AGTR1 (0.70) AGTR1AGTR2
SCHEMBL8080801 0.83 AGTR1 (0.76) AGTR1AGTR2
Dimethylamine SCHEMBL9851161 0.81 PPARG (0.61) AGTR1AGTR2PPARG
SCHEMBL9192150 0.80 PPARG (0.63) AGTR1AGTR2PPARG

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 2 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