SCHEMBL27972228

SCHEMBL27972228

CC(CSC(=O)c1ccccc1)C(=O)N1C[C@@H](c2cccs2)C[C@H]1C(=O)O.[CaH2]

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.63
▸ KMT2A Q03164 1/20 0.63
▸ DPP4 P27487 1/20 0.40
▸ AGTR2 P50052 2/20 0.40

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
SCHEMBL27972051 0.99 ACE (0.64) ACEKMT2ADPP4AGTR2
SCHEMBL7343606 0.81 ACE (0.73) ACEKMT2A
SCHEMBL7343609 0.81 ACE (0.73) ACEKMT2A
SCHEMBL7346776 0.79 ACE (0.80) ACEKMT2A
SCHEMBL7346780 0.79 ACE (0.80) ACEKMT2A
SCHEMBL11065209 0.79 ACE (0.49) ACEKMT2A
SCHEMBL11169739 0.79 ACE (0.49) ACEKMT2A
Zofenopril SCHEMBL388350 0.79 ACE (0.98) ACEKMT2A
Zofenopril SCHEMBL388351 0.79 ACE (0.98) ACEKMT2A
Zofenopril SCHEMBL1357585 0.79 ACE (0.98) 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
CN-103936644-A Method for preparing zofenopril calcium SHANGHAI HAINI PHARMACEUTICAL CO LTD YANGTZE RIVER PHARMACEUTICAL GROUP 2014-07-23 — — CN disclosed
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