SCHEMBL6891314

SCHEMBL6891314

C[C@H](NC(=O)N(CCO)CCc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.47
MME P08473 6/20 0.46
ACE P12821 2/20 0.46
PPARG P37231 4/20 0.46
PPARA Q07869 4/20 0.46
PPARD Q03181 2/20 0.46
MEN1 O00255 1/20 0.45
TSHR P16473 1/20 0.45
KMT2A Q03164 1/20 0.45
ANPEP P15144 1/20 0.45
EGLN1 Q9GZT9 1/20 0.44
PTGES O14684 1/20 0.43
CPA1 P15085 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
MMP3 P08254 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
SCHEMBL6890154 0.92 LPAR1 (0.53) LPAR1MMEACEMEN1TSHR
SCHEMBL6896205 0.92 LPAR1 (0.53) LPAR1MMEACEMEN1TSHR
SCHEMBL6897343 0.87 LPAR1 (0.46) LPAR1ACEMEN1TSHRKMT2A
SCHEMBL6890174 0.86 HSD17B10 (0.44) LPAR1PPARGPPARAMEN1TSHR
SCHEMBL6898167 0.86 LPAR1 (0.43) LPAR1MMEPPARGPPARAPPARD
SCHEMBL6898175 0.86 LPAR1 (0.57) LPAR1MMEACEMEN1TSHR
SCHEMBL6891035 0.85 PPARG (0.45) LPAR1MMEACEPPARGPPARA
SCHEMBL27559944 0.85 PPARG (0.45) LPAR1MMEACEPPARGPPARA
SCHEMBL6894648 0.84 MME (0.48) LPAR1MMEACECPA1ACE2
SCHEMBL6895621 0.84 MME (0.57) LPAR1MMEACECPA1ACE2

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 LPAR1 4229/4885MME 1516/4885ACE 1063/4885

“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.