SCHEMBL6891035

SCHEMBL6891035

CC(=O)SCCN(CCc1ccc(-c2ccccc2)cc1)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.45
PPARA Q07869 4/20 0.45
PPARD Q03181 2/20 0.45
LPAR1 Q92633 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
MME P08473 7/20 0.43
ACE P12821 3/20 0.43
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
PTGES O14684 1/20 0.40
ANPEP P15144 1/20 0.39
CPA1 P15085 2/20 0.39
ACE2 Q9BYF1 2/20 0.39

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
SCHEMBL27559944 1.00 PPARG (0.45) PPARGPPARAPPARDLPAR1EGLN1
SCHEMBL6898352 0.93 LPAR1 (0.48) LPAR1MMEACEMEN1TSHR
SCHEMBL6891444 0.93 LPAR1 (0.48) LPAR1MMEACEMEN1TSHR
SCHEMBL27543517 0.93 LPAR1 (0.48) LPAR1MMEACEMEN1TSHR
SCHEMBL6890752 0.89 LPAR1 (0.42) PPARGPPARAPPARDLPAR1EGLN1
SCHEMBL27559957 0.89 LPAR1 (0.42) PPARGPPARAPPARDLPAR1EGLN1
SCHEMBL6896867 0.88 HSD17B10 (0.40) PPARGPPARAPPARDLPAR1ACE
SCHEMBL27560035 0.88 LPAR1 (0.39) PPARGPPARAPPARDLPAR1MME
SCHEMBL6895896 0.88 LPAR1 (0.39) PPARGPPARAPPARDLPAR1MME
SCHEMBL27538379 0.88 HSD17B10 (0.40) PPARGPPARAPPARDLPAR1ACE

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 PPARG 3342/4885PPARA 3847/4885PPARD 2775/4885

“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.