SCHEMBL7753072

SCHEMBL7753072

CC(C)CCN(CCCO)C(=O)NC(Cc1ccccc1)C(=O)N(C)C

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 2/20 0.52
MMP8 P22894 2/20 0.52
MMP14 P50281 1/20 0.52
MME P08473 4/20 0.45
ACE P12821 3/20 0.45
PYGL P06737 8/20 0.44
LPAR1 Q92633 1/20 0.42
MMP3 P08254 1/20 0.41
PSMB1 P20618 1/20 0.41
PSMB5 P28074 1/20 0.41
PSMB2 P49721 1/20 0.41
CTSB P07858 1/20 0.40

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
SCHEMBL6890766 1.00 MMP9 (0.52) MMP9MMP8MMP14MMEACE
SCHEMBL6898835 0.97 MMP8 (0.51) MMP9MMP8MMP14MMEACE
SCHEMBL7752057 0.97 MMP8 (0.51) MMP9MMP8MMP14MMEACE
SCHEMBL7752030 0.93 MMP9 (0.54) MMP9MMP8MMP14MMEACE
SCHEMBL6897320 0.93 MMP9 (0.54) MMP9MMP8MMP14MMEACE
SCHEMBL6898216 0.86 MMP9 (0.47) MMP9MMP8MMP14MMEACE
SCHEMBL7748123 0.86 MMP9 (0.51) MMP9MMP8MMP14MMEACE
SCHEMBL6895678 0.86 MMP9 (0.51) MMP9MMP8MMP14MMEACE
SCHEMBL6894662 0.86 MMP9 (0.47) MMP9MMP8MMP14MMEACE
SCHEMBL6891245 0.84 MMP9 (0.49) MMP9MMP8MMP14MMEACE

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
CN-1299344-A Novel urea derivatives SANTEN PHARCEUMATICAL CO LTD (JP) 2001-06-13 CN disclosed
EP-1072591-A1 NOVEL UREA DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-01-31 EP disclosed