SCHEMBL2544784

SCHEMBL2544784

NCCCC[C@H](N)C(=O)OC1CCCC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.47
DPP7 Q9UHL4 13/20 0.45
DPP8 Q6V1X1 7/20 0.45
DPP4 P27487 5/20 0.45
DPP9 Q86TI2 5/20 0.43
FAP Q12884 1/20 0.43
TPSAB1 Q15661 3/20 0.43
TPSD1 Q9BZJ3 3/20 0.43
TPSG1 Q9NRR2 3/20 0.43
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40

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
SCHEMBL7782967 0.98 GSR (0.46) GSRDPP7DPP8DPP4DPP9
SCHEMBL7782965 0.98 GSR (0.46) GSRDPP7DPP8DPP4DPP9
Hydrochloric Acid SCHEMBL11524970 0.97 GSR (0.44) GSRDPP7DPP8DPP4DPP9
Hydrochloric Acid SCHEMBL11524966 0.97 GSR (0.44) GSRDPP7DPP8DPP4DPP9
SCHEMBL28614001 0.93 MAPK13 (0.40) GSRDPP7DPP8DPP4DPP9
SCHEMBL23454411 0.88 DPP7 (0.44) GSRDPP7DPP8DPP4DPP9
SCHEMBL10611587 0.88 GSR (0.42) GSRDPP7DPP8DPP4DPP9
SCHEMBL10611597 0.88 GSR (0.42) GSRDPP7DPP8DPP4DPP9
SCHEMBL15543405 0.85 MAPK13 (0.39) DPP7DPP4TPSAB1TPSD1TPSG1
SCHEMBL15543404 0.85 MAPK13 (0.39) DPP7DPP8DPP4TPSAB1TPSD1

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
EP-2013175-B9 p38 MAP KINASE INHIBITORS MACROPHAGE PHARMA LTD (GB) 2020-11-11 EP disclosed
EP-2013175-B1 p38 MAP KINASE INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2016-11-09 EP disclosed
US-8044211-B2 P38 MAP kinase inhibitors CHROMA THERAPEUTICS LTD. (GB) 2011-10-25 US disclosed
US-20090099185-A1 P38 Map Kinase Inhibitors CHROMA THERAPEUTICS LTD. (GB) 2009-04-16 US 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-20090099185-A1 P38 Map Kinase Inhibitors MAPK1, CNKSR1, MAPK3 GSR 1509/4885DPP7 3110/4885DPP8 3508/4885

“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.