SCHEMBL9402495

SCHEMBL9402495

CCCCc1nnc(SCc2ccc(Cl)cc2)n1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 1/20 0.51
▸ AGTR2 P50052 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
SCHEMBL9402197 0.88 ALDH1A1 (0.51) AGTR1AGTR2
SCHEMBL9402474 0.86 PPARG (0.55) —
SCHEMBL9402349 0.83 AGTR1 (0.65) AGTR1AGTR2
SCHEMBL9402340 0.82 PPARG (0.47) —
SCHEMBL9402342 0.81 — —
SCHEMBL9402252 0.81 AGTR1 (0.53) AGTR1
SCHEMBL9448503 0.80 PPARG (0.57) AGTR1AGTR2
SCHEMBL9402464 0.80 PPARG (0.48) AGTR1AGTR2
SCHEMBL7409233 0.79 HTT (0.51) —
SCHEMBL9402287 0.79 LMNA (0.51) —

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-5336778-A Substituted triazoles as angiotensin II antagonists MERCK & CO., INC. (US) 1994-08-09 — — US disclosed
EP-0409332-A2 Substituted triazoles as angiotensin II antagonists MERCK & CO. INC. (US) 1991-01-23 — — EP disclosed
Send feedback