SCHEMBL8449504

SCHEMBL8449504

CC(C)CN(C[C@H](CCc1ccccc1)C(=O)Oc1ccc2c(c1)CCC2)C(=O)N[C@H](C(=O)O)C(Cc1ccccc1)c1ccc2ccccc2c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.40
ACE P12821 5/20 0.40
PPARG P37231 3/20 0.35
PPARD Q03181 3/20 0.35
UTS2R Q9UKP6 3/20 0.34
MMEL1 Q495T6 1/20 0.33
PTGES O14684 1/20 0.33
PPARA Q07869 1/20 0.33
MMP3 P08254 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32

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
SCHEMBL8447132 0.93 MME (0.40) MMEACEPPARGPPARDMMEL1
SCHEMBL8447129 0.88 MME (0.41) MMEACEPPARGPPARDMMEL1
SCHEMBL8450833 0.87 MME (0.42) MMEACEPPARGPPARDMMEL1
SCHEMBL7572570 0.85 MME (0.58) MMEACE
SCHEMBL7572563 0.85 MME (0.58) MMEACE
SCHEMBL8446482 0.85 MME (0.49) MMEACEUTS2R
SCHEMBL8449483 0.84 MME (0.42) MMEACEUTS2RPTGESMMP3
SCHEMBL7574128 0.83 MME (0.53) MMEACEPPARGPPARDMMEL1
SCHEMBL7570073 0.83 MME (0.53) MMEACEPPARGPPARDMMEL1
SCHEMBL8447142 0.82 MME (0.47) MMEACEUTS2R

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