SCHEMBL6897220

SCHEMBL6897220

CC(=O)SCCN(CCc1ccccc1)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)NCCN(C)C

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MME P08473 5/20 0.44
ACE P12821 4/20 0.44
CTSB P07858 3/20 0.43
CTSS P25774 3/20 0.43
CTSL P07711 2/20 0.43
MMP9 P14780 4/20 0.42
MMP8 P22894 4/20 0.42
MMP2 P08253 2/20 0.42
CTSK P43235 2/20 0.42
UTS2R Q9UKP6 2/20 0.41
FCER2 P06734 2/20 0.41
ALOX5 P09917 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
SCHEMBL6895814 0.91 CTSS (0.42) CTSSMMP8CTSK
SCHEMBL6899419 0.90 KIFC1 (0.45) MMEACECTSBCTSSMMP9
SCHEMBL6898419 0.89 OPRM1 (0.44) CTSLMMP9MMP8MMP2
SCHEMBL6895441 0.89 MME (0.47) MMEACECTSBCTSSCTSL
SCHEMBL6897068 0.88 KMT2A (0.47) CTSSCTSLMMP9MMP2CTSK
SCHEMBL6899191 0.88 AVPR1A (0.46) CTSLMMP8UTS2R
SCHEMBL6890698 0.88 KIFC1 (0.42) CTSSCTSLMMP8CTSK
SCHEMBL27538457 0.88 AVPR1A (0.46) CTSLMMP8UTS2R
SCHEMBL6890575 0.87 SRC (0.42) MMP8
SCHEMBL6895729 0.86 MEN1 (0.41) CTSSCTSLMMP8CTSK

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 4 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
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 1063/4885CTSB 1387/4885

“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.