SCHEMBL30525014

SCHEMBL30525014

CS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ LOX P28300 1/20 0.52
▸ CNR2 P34972 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50

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
SCHEMBL20790942 1.00 CA2 (0.58) CA2TDP1L3MBTL1LOXCNR2
SCHEMBL20811392 0.90 LOX (0.52) LOXCNR2
SCHEMBL30524884 0.89 LOX (0.53) CA2LOX
SCHEMBL30524711 0.89 LOX (0.53) CA2LOX
SCHEMBL30524740 0.89 LOX (0.53) CA2LOX
SCHEMBL30525052 0.88 CA2 (0.56) CA2TDP1L3MBTL1LOXALDH1A1
SCHEMBL20791141 0.88 CA2 (0.56) CA2TDP1L3MBTL1LOXALDH1A1
SCHEMBL28069383 0.88 CA2 (0.73) CA2TDP1L3MBTL1LOXALDH1A1
SCHEMBL30524816 0.85 LOX (0.50) LOXCNR2
SCHEMBL6787220 0.85 CA2 (0.59) CA2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111601798-B Bisamide sarcomere activating compounds and uses thereof 美国安进公司 2023-08-11 — — CN disclosed
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