SCHEMBL9402176

SCHEMBL9402176

CCCCc1nnc(Cl)n1Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ KCNH2 Q12809 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ AGTR1 P30556 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
SCHEMBL9402286 0.81 POLB (0.43) TLR7ACHEL3MBTL1
SCHEMBL9402388 0.81 ALDH1A1 (0.56) —
SCHEMBL9402501 0.79 ALDH1A1 (0.47) —
SCHEMBL9402406 0.79 ALDH1A1 (0.49) MEN1KMT2A
SCHEMBL9402270 0.79 ALDH1A1 (0.67) —
SCHEMBL9402222 0.79 LMNA (0.49) TLR7ACHEMEN1KMT2A
SCHEMBL7412061 0.78 ALDH1A1 (0.55) —
SCHEMBL277 0.77 AGTR1 (0.60) AGTR1
SCHEMBL7320199 0.77 TLR7 (0.48) TLR7ACHEMEN1KMT2AAGTR1
SCHEMBL649 0.77 AGTR1 (0.58) TLR7AGTR1

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
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