SCHEMBL6897715

SCHEMBL6897715

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

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 16/20 0.45
MMP1 P03956 14/20 0.45
MMP3 P08254 11/20 0.45
MMP7 P09237 4/20 0.45
MMP9 P14780 5/20 0.44
MMP8 P22894 3/20 0.44
FCER2 P06734 2/20 0.44
MMP14 P50281 1/20 0.42
ADAM17 P78536 1/20 0.42

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
SCHEMBL27541796 1.00 MMP2 (0.45) MMP2MMP1MMP3MMP7MMP9
SCHEMBL6898910 0.94 MMP1 (0.46) MMP2MMP1MMP3MMP7MMP9
SCHEMBL27541579 0.91 MME (0.48) MMP2MMP1MMP3MMP7MMP9
SCHEMBL6897823 0.91 MME (0.48) MMP2MMP1MMP3MMP7MMP9
SCHEMBL6897211 0.88 MMP1 (0.41) MMP2MMP1MMP3MMP7MMP9
SCHEMBL27559987 0.88 MMP1 (0.41) MMP2MMP1MMP3MMP7MMP9
SCHEMBL6898127 0.88 MMP1 (0.47) MMP2MMP1MMP3MMP7MMP9
SCHEMBL27543473 0.88 MMP1 (0.47) MMP2MMP1MMP3MMP7MMP9
SCHEMBL6895549 0.86 MMP1 (0.50) MMP2MMP1MMP3MMP7MMP9
SCHEMBL27541804 0.86 MMP1 (0.50) MMP2MMP1MMP3MMP7MMP9

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 MMP2 3359/4885MMP1 3883/4885MMP3 4452/4885

“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.