SCHEMBL11333708

SCHEMBL11333708

CC(C)(C)C(=O)CC(C)(S)C(=O)N[C@@H](CSC(=O)C(C)(C)C)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 13/20 0.34
▸ MME P08473 1/20 0.34
▸ ACE2 Q9BYF1 1/20 0.34
▸ PPARG P37231 1/20 0.30
▸ PPARA Q07869 1/20 0.30

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
SCHEMBL11198946 0.84 ACE (0.47) ACEMMEACE2PPARGPPARA
SCHEMBL4576379 0.82 PPARG (0.35) ACEMMEACE2PPARGPPARA
SCHEMBL4576383 0.82 PPARG (0.35) ACEMMEACE2PPARGPPARA
SCHEMBL11333699 0.78 PPARG (0.33) ACEMMEACE2PPARGPPARA
SCHEMBL11337780 0.77 ACE (0.35) ACEMMEACE2
SCHEMBL8582126 0.76 MAPT (0.48) ACEPPARGPPARA
SCHEMBL18954453 0.71 PPARA (0.55) ACEPPARGPPARA
SCHEMBL20122455 0.70 ACE (0.48) ACEMMEACE2
SCHEMBL11331818 0.69 ACE (0.43) ACEMMEACE2PPARGPPARA
SCHEMBL20122457 0.68 ACE (0.46) ACEMMEACE2

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-4255446-A SUPPRESSING LIVER DISORDERS SANTEN PHARMACEUTICAL CO. LTD. (JP) 1981-03-10 — — US claimed
US-4255446-A SUPPRESSING LIVER DISORDERS SANTEN PHARMACEUTICAL CO. LTD. (JP) 1981-03-10 — — US disclosed
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