SCHEMBL6891310

SCHEMBL6891310

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

nearest known ligand 0.66

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
MME P08473 5/20 0.46
LMNA P02545 1/20 0.46
PAM P19021 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45
PTPN1 P18031 1/20 0.44
PSMB1 P20618 1/20 0.44
PSMB5 P28074 1/20 0.44
PSMB2 P49721 1/20 0.44
NAALAD2 Q9Y3Q0 1/20 0.44
ACE P12821 3/20 0.44
PPARG P37231 1/20 0.44
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
LPAR1 Q92633 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
SCHEMBL27541800 1.00 L3MBTL1 (0.46) L3MBTL1MMELMNAPAMNPSR1
SCHEMBL27576372 0.85 HCRTR1 (0.48) NPSR1
SCHEMBL27576368 0.85 HCRTR1 (0.48) NPSR1
SCHEMBL27538252 0.84 LPAR1 (0.50) L3MBTL1MMELMNAPAMNPSR1
SCHEMBL6896981 0.84 LPAR1 (0.50) L3MBTL1MMELMNAPAMNPSR1
SCHEMBL6895655 0.83 ITGA4 (0.54) L3MBTL1MMELMNANPSR1CA12
SCHEMBL6897834 0.83 HSD17B10 (0.49)
SCHEMBL27538320 0.83 HSD17B10 (0.49)
SCHEMBL27543400 0.82 MME (0.53) L3MBTL1MMELMNANAALAD2ACE
SCHEMBL6897078 0.82 MME (0.53) L3MBTL1MMELMNANAALAD2ACE

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 L3MBTL1 3448/4885MME 1516/4885LMNA 4204/4885

“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.