SCHEMBL8700579

SCHEMBL8700579

CCCCc1nc2ccnc(Cl)c2n1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.61
AGTR2 P50052 4/20 0.48
AGTR1 P30556 3/20 0.47

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
SCHEMBL9443254 0.85 PPARG (0.66) PPARGAGTR2AGTR1
SCHEMBL9195236 0.84 PPARG (0.64) PPARGAGTR2AGTR1
SCHEMBL9192065 0.83 PPARG (0.63) PPARGAGTR2AGTR1
SCHEMBL9194185 0.83 PPARG (0.63) PPARGAGTR2AGTR1
SCHEMBL9192150 0.83 PPARG (0.63) PPARGAGTR2AGTR1
SCHEMBL9851543 0.83 AGTR1 (0.66) PPARGAGTR2AGTR1
SCHEMBL9704682 0.82 AGTR2 (0.70) PPARGAGTR2AGTR1
Dimethylamine SCHEMBL9192520 0.82 PPARG (0.62) PPARGAGTR2AGTR1
SCHEMBL9193729 0.82 PPARG (0.62) PPARGAGTR2AGTR1
SCHEMBL9197325 0.82 PPARG (0.88) PPARGAGTR2AGTR1

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-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
US-5321137-A Process for the preparation of imidazopyridines MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-06-14 US disclosed