SCHEMBL9402239

SCHEMBL9402239

CCCCc1nnc(SCCO)n1Cc1ccc(N)cc1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.46

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
SCHEMBL9402501 0.83 ALDH1A1 (0.47) ALDH1A1
SCHEMBL9589231 0.83 HTT (0.47) ALDH1A1
SCHEMBL9402287 0.82 LMNA (0.51) ALDH1A1
SCHEMBL9402219 0.82 — —
SCHEMBL9402246 0.81 ALDH1A1 (0.51) ALDH1A1
SCHEMBL9402392 0.81 ALDH1A1 (0.52) ALDH1A1
SCHEMBL9402365 0.79 TLR7 (0.50) —
SCHEMBL9767534 0.77 MEN1 (0.45) ALDH1A1
SCHEMBL11511765 0.75 NPC1 (0.53) ALDH1A1
SCHEMBL9402206 0.75 AGTR1 (0.57) —

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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