SCHEMBL8336390

SCHEMBL8336390

COCC[C@H](CC1(C(=O)NC(CCOc2ccc(Cl)cc2)CC(=O)O)CCCC1)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 11/20 0.60
ACE P12821 1/20 0.42
MMP1 P03956 5/20 0.40
NPPA P01160 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGA4 P13612 1/20 0.39
KMT2A Q03164 1/20 0.38

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
SCHEMBL5702665 1.00 MME (0.60) MMEACEMMP1NPPAITGB1
SCHEMBL5702602 1.00 MME (0.60) MMEACEMMP1NPPAITGB1
SCHEMBL5702567 0.92 MME (0.56) MME
SCHEMBL5702572 0.92 MME (0.56) MME
SCHEMBL5702643 0.90 MME (0.56) MMEMMP1NPPA
SCHEMBL8334290 0.90 MME (0.50) MMEACEMMP1ITGB1ITGA4
SCHEMBL5702538 0.90 MME (0.57) MMEMMP1ITGB1ITGA4KMT2A
SCHEMBL5702593 0.90 MME (0.49) MMEACEMMP1NPPA
SCHEMBL5702625 0.90 MME (0.49) MMEACEMMP1NPPA
SCHEMBL5702547 0.88 MME (0.72) MMEACEMMP1NPPAITGB1

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-2004056750-A1 CYCLOPENTIL-SUBSTITUTED GLUTARAMIDE COMPOUNDS AS ENDOPEPTIDASE INHIBITORS PFIZER LIMITED (GB) 2004-07-08 WO disclosed