SCHEMBL8446489

SCHEMBL8446489

CCCCOC(=O)CCN(CC(C)C)C(=O)N[C@H](C(=O)O)C(Cc1ccccc1)c1ccc2ccccc2c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.45
ACE P12821 2/20 0.43
CTSB P07858 1/20 0.41
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38
CYP26A1 O43174 1/20 0.37
CTSD P07339 7/20 0.37
MMEL1 Q495T6 1/20 0.36
UTS2R Q9UKP6 2/20 0.36
LTA4H P09960 1/20 0.36

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
SCHEMBL8446449 0.92 MME (0.47) MMEACECTSBPPARGPPARA
SCHEMBL8453149 0.90 MME (0.47) MMEACECTSBCYP26A1UTS2R
SCHEMBL8452849 0.89 ACE (0.45) MMEACECTSBPPARGPPARD
SCHEMBL8450108 0.84 MME (0.45) MMEACECTSBUTS2R
SCHEMBL7568461 0.82 MME (0.67) MMEACE
SCHEMBL8446426 0.80 MME (0.48) MMEACECTSBMMEL1LTA4H
SCHEMBL8446488 0.79 MME (0.56) MMEACECTSB
SCHEMBL8451198 0.78 MME (0.48) MMEACECTSB
SCHEMBL8452068 0.78 MME (0.48) MMEACECTSB
SCHEMBL8446482 0.78 MME (0.49) MMEACECTSBUTS2R

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
US-5968980-A ENDOPEPTIDASE 24.11 INHIBITORS SANTEN PHARMACEUTICAL CO., LTD. (JP) 1999-10-19 US disclosed