SCHEMBL7314280

SCHEMBL7314280

[CH]=Cc1ccc(SC)c(SC)c1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL3406735 0.77 ALDH1A1 (0.52) ALDH1A1
SCHEMBL7314285 0.77 ALDH1A1 (0.43) ALDH1A1
SCHEMBL7317059 0.74
SCHEMBL2097370 0.74 LCK (0.32) ALDH1A1
SCHEMBL2097373 0.74 LCK (0.32) ALDH1A1
SCHEMBL7324100 0.72 GSK3B (0.33)
SCHEMBL2622637 0.70 MAOB (0.52) ALDH1A1
SCHEMBL5950755 0.69 ALDH1A1 (0.58) ALDH1A1
SCHEMBL7648904 0.67 APP (0.35) ALDH1A1
SCHEMBL11261432 0.67 ALOX15 (0.48) ALDH1A1

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-4845100-A WITH HYPOTENSIVE AND ANTIINFLAMMATORY ACTIVITY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-07-04 US disclosed
EP-0202760-A2 Carbostyril derivatives and salts thereof, processes for preparing the same and cardiotonic composition containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-11-26 EP disclosed