SCHEMBL6237582

SCHEMBL6237582

N[C@@H](Cc1ccc(O)cc1)C(=O)C1CCN1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.56
SLC7A5 Q01650 1/20 0.53
HDAC8 Q9BY41 3/20 0.45
OPRD1 P41143 1/20 0.43
TACR1 P25103 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
SCHEMBL6237578 1.00 DPP4 (0.56) DPP4SLC7A5HDAC8OPRD1TACR1
SCHEMBL6232055 0.89 DPP4 (0.56) DPP4SLC7A5HDAC8OPRD1TACR1
SCHEMBL6232052 0.89 DPP4 (0.56) DPP4SLC7A5HDAC8OPRD1TACR1
SCHEMBL7694794 0.81 DPP4 (0.54) DPP4SLC7A5HDAC8OPRD1
SCHEMBL6231881 0.75 DPP4 (0.33) DPP4TACR1
SCHEMBL6231883 0.75 DPP4 (0.33) DPP4TACR1
SCHEMBL5336562 0.74 DPP4 (0.68) DPP4OPRD1
SCHEMBL29477123 0.74 DPP4 (0.68) DPP4OPRD1
SCHEMBL6231258 0.73 DPP4 (0.44) DPP4
SCHEMBL6234277 0.73 PTGS1 (0.41) DPP4

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6927290-B2 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-08-09 US disclosed
EP-1160236-B1 Production of mixed acid anhydride and amine compound SUMITOMO CHEMICAL CO (JP) 2005-05-25 EP disclosed
US-20040210059-A1 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL COMPANY, LIMITED 2004-10-21 US disclosed
US-6753431-B2 REACTING A CARBAMATE DERIVATIVE WITH CARBOXYLIC AND HALOFORMIC ACID DERIVATIVES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2004-06-22 US disclosed
US-20020032346-A1 Production of mixed acid anhydride and amide compound SUMITOMO CHEMICAL CO., LTD. 2002-03-14 US disclosed
EP-1160236-A2 Production of mixed acid anhydride and amine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-12-05 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 (2 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-20040210059-A1 Production of mixed acid anhydride and amide compound CA2, CA1, CA3 DPP4 4479/4885SLC7A5 1959/4885HDAC8 1040/4885
US-20020032346-A1 Production of mixed acid anhydride and amide compound CA2, CA1, CA3 DPP4 4479/4885SLC7A5 1959/4885HDAC8 1040/4885

“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.