SCHEMBL6896715

SCHEMBL6896715

O=C(O)[C@H](Cc1ccc(O)cc1)NC(=O)N(CCO)CCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACE P12821 8/20 0.54
MME P08473 7/20 0.54
LPAR1 Q92633 1/20 0.48
OPRM1 P35372 2/20 0.47
OPRD1 P41143 2/20 0.47
OPRK1 P41145 2/20 0.47
FOLH1 Q04609 1/20 0.46
NAALAD2 Q9Y3Q0 1/20 0.46
CPA1 P15085 1/20 0.46
ACE2 Q9BYF1 1/20 0.46

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
SCHEMBL27538262 0.94 LPAR1 (0.53) ACEMMELPAR1NAALAD2CPA1
SCHEMBL6895388 0.94 LPAR1 (0.53) ACEMMELPAR1NAALAD2CPA1
SCHEMBL6891317 0.94 LPAR1 (0.53) ACEMMELPAR1NAALAD2CPA1
SCHEMBL6895621 0.92 MME (0.57) ACEMMELPAR1CPA1ACE2
SCHEMBL7051183 0.89 ALDH1A1 (0.55) ACEMMELPAR1CPA1ACE2
SCHEMBL27538344 0.89 LPAR1 (0.48) ACEMMELPAR1CPA1ACE2
SCHEMBL6890555 0.89 LPAR1 (0.48) ACEMMELPAR1CPA1ACE2
SCHEMBL27559954 0.88 PPARG (0.56) ACEMMECPA1ACE2
SCHEMBL6898401 0.88 PPARG (0.56) ACEMMECPA1ACE2
SCHEMBL6893733 0.86 LPAR1 (0.56) ACEMMELPAR1NAALAD2CPA1

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

“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.