SCHEMBL11110226

SCHEMBL11110226

C[C@H](CSC(=O)c1ccccc1)C(=O)N1C(c2ccccc2)SC[C@H]1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ HSD17B10 Q99714 1/20 0.47
▸ FFAR2 O15552 2/20 0.47
▸ POLB P06746 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42

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
SCHEMBL11068373 0.94 KMT2A (0.50) ACEKMT2AHSD17B10FFAR2POLB
SCHEMBL11248462 0.93 KMT2A (0.49) ACEKMT2AHSD17B10FFAR2POLB
SCHEMBL11234749 0.90 ACE (0.47) ACEKMT2AHSD17B10FFAR2ALDH1A1
SCHEMBL11062257 0.87 ACE (0.55) ACEKMT2AFFAR2
SCHEMBL11169739 0.86 ACE (0.49) ACEKMT2AFFAR2
SCHEMBL11065209 0.86 ACE (0.49) ACEKMT2AFFAR2
SCHEMBL11184479 0.86 FFAR2 (0.52) ACEKMT2AHSD17B10FFAR2POLB
SCHEMBL11066444 0.85 ACE (0.43) ACEKMT2AHSD17B10FFAR2ALDH1A1
SCHEMBL11104679 0.83 ACE (0.46) ACEKMT2AFFAR2
SCHEMBL11181655 0.83 ACE (0.50) ACEKMT2A

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
US-4457935-A ANGIOTENSIN-CONVERTING ENZYME INHIBITOR SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-07-03 — — US claimed
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