SCHEMBL7338312

SCHEMBL7338312

O=C(O)C1CCCN1C(=O)N1CCCCCC1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.49
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL7338310 1.00 ACE (0.49) ACEALDH1A1
SCHEMBL7763711 0.98 ACE (0.50) ACE
SCHEMBL7876424 0.96 ALDH1A1 (0.46) ACEALDH1A1
SCHEMBL3713013 0.96 ALDH1A1 (0.46) ACEALDH1A1
SCHEMBL31097181 0.94 ACE (0.46) ACE
SCHEMBL28101081 0.86 ACE (0.56) ACE
SCHEMBL3795434 0.84 CNR1 (0.47) ACE
SCHEMBL3708847 0.84 MEN1 (0.48) ACE
SCHEMBL3708845 0.84 MEN1 (0.48) ACE
SCHEMBL16238580 0.83 CNR2 (0.49) 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-6423689-B1 Peptidyl calcium channel blockers WARNER-LAMBERT COMPANY 2002-07-23 US claimed
US-6423689-B1 Peptidyl calcium channel blockers WARNER-LAMBERT COMPANY 2002-07-23 US disclosed