SCHEMBL27913976

SCHEMBL27913976

O=C(O)C(O)CNN(Cc1ccc(-c2ccccc2)cc1)C(=O)c1cc(Cl)c2[nH]nnc2c1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 20/20 0.39
▸ ACE P12821 1/20 0.37

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
SCHEMBL27932184 0.89 MME (0.41) MME
SCHEMBL9935256 0.80 MME (0.52) MMEACE
SCHEMBL9935261 0.80 MME (0.52) MMEACE
SCHEMBL27913955 0.78 MME (0.39) MME
SCHEMBL27913953 0.75 MME (0.58) MME
SCHEMBL16458366 0.75 MME (0.48) MMEACE
SCHEMBL16458038 0.74 MME (0.51) MME
SCHEMBL16458036 0.74 MME (0.51) MME
SCHEMBL28023724 0.72 MME (0.51) MME
SCHEMBL27932200 0.72 MME (0.37) MMEACE

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-103261168-A Enkephalinase inhibitors THERAVANCE INC 2013-08-21 — — CN disclosed
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