SCHEMBL11104265

SCHEMBL11104265

C[C@H](CSC(=O)c1ccccc1)C(=O)N1C(c2cc(Cl)ccc2O)SC[C@H]1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 3/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ FFAR2 O15552 7/20 0.43
▸ HTT P42858 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
SCHEMBL11062257 0.89 ACE (0.55) ACEKMT2ALMNAFFAR2HTT
SCHEMBL11219793 0.89 ACE (0.43) ACELMNAFFAR2HTT
SCHEMBL11104668 0.84 ACE (0.48) ACELMNAFFAR2
SCHEMBL11110226 0.82 ACE (0.53) ACEKMT2AFFAR2
SCHEMBL11104269 0.81 LMNA (0.46) ACEKMT2ALMNAFFAR2HTT
SCHEMBL11068373 0.79 KMT2A (0.50) ACEKMT2AFFAR2
SCHEMBL11104679 0.79 ACE (0.46) ACEKMT2ALMNAFFAR2HTT
SCHEMBL11194036 0.78 ACE (0.59) ACELMNAFFAR2HTT
SCHEMBL11248462 0.78 KMT2A (0.49) ACEKMT2AFFAR2
SCHEMBL11169739 0.78 ACE (0.49) ACEKMT2ALMNAFFAR2HTT

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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