SCHEMBL6898835

SCHEMBL6898835

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

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 3/20 0.51
MMP9 P14780 2/20 0.51
MMP14 P50281 1/20 0.51
MME P08473 3/20 0.44
ACE P12821 2/20 0.44
PYGL P06737 8/20 0.43
LPAR1 Q92633 2/20 0.43
MMP3 P08254 2/20 0.41
MMP1 P03956 1/20 0.40
PSMB1 P20618 1/20 0.40
PSMB5 P28074 1/20 0.40
PSMB2 P49721 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
SCHEMBL7752057 1.00 MMP8 (0.51) MMP8MMP9MMP14MMEACE
SCHEMBL7753072 0.97 MMP9 (0.52) MMP8MMP9MMP14MMEACE
SCHEMBL6890766 0.97 MMP9 (0.52) MMP8MMP9MMP14MMEACE
SCHEMBL7752030 0.92 MMP9 (0.54) MMP8MMP9MMP14MMEACE
SCHEMBL6897320 0.92 MMP9 (0.54) MMP8MMP9MMP14MMEACE
SCHEMBL6894662 0.87 MMP9 (0.47) MMP8MMP9MMP14MMEACE
SCHEMBL6898216 0.85 MMP9 (0.47) MMP8MMP9MMP14MMEACE
SCHEMBL7748123 0.85 MMP9 (0.51) MMP8MMP9MMP14MMEACE
SCHEMBL6895678 0.85 MMP9 (0.51) MMP8MMP9MMP14MMEACE
SCHEMBL6891245 0.83 MMP9 (0.49) MMP8MMP9MMP14MMEACE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6730784-B2 AS THERAPEUTIC AGENTS FOR AUTOIMMUNE DISEASES SUCH AS RHEUMATOID ARTHRITIS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2004-05-04 US disclosed
US-20020198376-A1 Novel urea derivatives SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-26 US disclosed
US-6492370-B1 Urea derivatives and pharmaceutical compositions thereof SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-12-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020198376-A1 Novel urea derivatives TNF, CTH, CFH MMP8 3131/4885MMP9 3772/4885MMP14 4605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.