SCHEMBL17169875

SCHEMBL17169875

CC(C)OC(=O)OCOC(=O)CCC(=O)N[C@H](Cc1ccc(-c2ccccc2)cc1)C[C@@H](C)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 13/20 0.69
▸ ACE P12821 4/20 0.69
▸ MMEL1 Q495T6 7/20 0.57

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
SCHEMBL17169876 0.92 MME (0.57) MMEACEMMEL1
SCHEMBL28450662 0.90 MME (0.77) MMEACEMMEL1
SCHEMBL28450664 0.90 MME (0.77) MMEACEMMEL1
SCHEMBL7436015 0.87 MME (0.76) MMEACEMMEL1
SCHEMBL28456484 0.87 MME (0.76) MMEACEMMEL1
SCHEMBL22585406 0.86 MME (0.74) MMEACEMMEL1
SCHEMBL22556618 0.85 MME (0.80) MMEACEMMEL1
SCHEMBL22556619 0.85 MME (0.80) MMEACEMMEL1
SCHEMBL3605256 0.84 MME (0.71) MMEACEMMEL1
SCHEMBL17169811 0.83 MME (0.76) MMEACEMMEL1

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
WO-2015154673-A1 NOVEL PRODRUGS AND COMBINATIONS FOR TREATMENT OF HYPERTENSION AND CARDIOVASCULAR DISEASES WANG ZHAOYIN (CN) 2015-10-15 — — WO disclosed
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