SCHEMBL6897823

SCHEMBL6897823

CNC(=O)[C@H](Cc1ccccc1)NC(=O)N(CCSC(C)=O)CC(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.48
ACE P12821 3/20 0.48
MMP1 P03956 12/20 0.47
MMP2 P08253 6/20 0.47
MMP3 P08254 5/20 0.47
FCER2 P06734 5/20 0.46
MMP9 P14780 4/20 0.46
MMP8 P22894 3/20 0.46
MMP7 P09237 3/20 0.46
CTSB P07858 1/20 0.45
ADAM17 P78536 1/20 0.44
MMP14 P50281 1/20 0.43

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
SCHEMBL27541579 1.00 MME (0.48) MMEACEMMP1MMP2MMP3
SCHEMBL6898910 0.93 MMP1 (0.46) MMEACEMMP1MMP2MMP3
SCHEMBL27541796 0.91 MMP2 (0.45) MMP1MMP2MMP3FCER2MMP9
SCHEMBL6897715 0.91 MMP2 (0.45) MMP1MMP2MMP3FCER2MMP9
SCHEMBL6898127 0.88 MMP1 (0.47) MMP1MMP2MMP3FCER2MMP9
SCHEMBL27543473 0.88 MMP1 (0.47) MMP1MMP2MMP3FCER2MMP9
SCHEMBL6897211 0.87 MMP1 (0.41) MMEACEMMP1MMP2MMP3
SCHEMBL27559987 0.87 MMP1 (0.41) MMEACEMMP1MMP2MMP3
SCHEMBL6898115 0.85 MME (0.53) MMEACEMMP1MMP2MMP3
SCHEMBL27541544 0.85 MME (0.53) MMEACEMMP1MMP2MMP3

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 5 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
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

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 MME 1516/4885ACE 1063/4885MMP1 3883/4885

“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.