SCHEMBL8668741

SCHEMBL8668741

CC(C)(C)OC(=O)NCC(=O)N1C(C(=O)O)CCC1c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.53
▸ MME P08473 1/20 0.53

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
SCHEMBL8870406 1.00 ACE (0.53) ACEMME
SCHEMBL8871191 1.00 ACE (0.53) ACEMME
SCHEMBL8871413 0.94 ACE (0.48) ACEMME
SCHEMBL8870127 0.92 SIGMAR1 (0.50) ACEMME
SCHEMBL8870137 0.92 SIGMAR1 (0.50) ACEMME
SCHEMBL8869883 0.89 ACE (0.43) ACEMME
SCHEMBL8869892 0.89 ACE (0.43) ACEMME
SCHEMBL8870712 0.85 MME (0.42) ACEMME
SCHEMBL8870704 0.85 MME (0.42) ACEMME
SCHEMBL8668739 0.81 ACE (0.47) ACE

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5707991-A TREATMENT OF NERVOUS SYSTEM DISORDERS, PARKINSON'S DISEASE RHONE-POULENC RORER S.A. (FR) 1998-01-13 — — US disclosed
US-5610144-A CHOLECYSTOKININ OR GASTRIN ANTAGONISTS; NERVOUS SYSTEM AND GASTROINTESTINAL DISORDERS RHONE-POULENC RORER S.A. (FR) 1997-03-11 — — US disclosed
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