SCHEMBL8056271

SCHEMBL8056271

CC(=O)NC1CCc2ccccc2N(CC(=O)O)C1=O

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACE P12821 15/20 0.74
MME P08473 9/20 0.74
CCKBR P32239 3/20 0.66

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
SCHEMBL7359930 0.88 ACE (0.59) ACEMMECCKBR
SCHEMBL10908180 0.87 ACE (0.76) ACEMMECCKBR
SCHEMBL10908178 0.87 ACE (0.76) ACEMMECCKBR
SCHEMBL27662942 0.86 ACE (0.68) ACEMMECCKBR
SCHEMBL8050289 0.86 ACE (0.70) ACEMMECCKBR
SCHEMBL11050154 0.84 ACE (0.66) ACEMMECCKBR
SCHEMBL8673708 0.84 ACE (0.66) ACEMMECCKBR
SCHEMBL7488630 0.84 ACE (0.65) ACEMMECCKBR
SCHEMBL7389206 0.83 ACE (0.65) ACEMMECCKBR
SCHEMBL10200768 0.83 ACE (0.67) ACEMMECCKBR

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
EP-0994894-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 2000-04-26 EP disclosed
WO-1999007731-A1 SELECTIVE FACTOR Xa INHIBITORS COR THERAPEUTICS, INC. (US) 1999-02-18 WO disclosed