SCHEMBL21554816

SCHEMBL21554816

CONC(=O)C(=O)[C@H](Cc1ccccc1)NC(=O)C(CC1CC1)NC(=O)c1cccc(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 2/20 0.58
CTSL P07711 7/20 0.50
CTSS P25774 6/20 0.50
GPR132 Q9UNW8 1/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 1/20 0.46
F10 P00742 2/20 0.45
PRSS1 P07477 2/20 0.45
CCR3 P51677 1/20 0.45
KLKB1 P03952 1/20 0.45
CTSK P43235 2/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL21526186 1.00 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1
SCHEMBL26368543 1.00 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1
SCHEMBL21526185 1.00 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1
SCHEMBL23921538 0.92 GPR139 (0.58) GPR139CTSLCTSSCTSK
SCHEMBL23921569 0.92 GPR139 (0.58) GPR139CTSLCTSSCTSK
SCHEMBL21526219 0.90 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1
SCHEMBL21554817 0.90 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1
SCHEMBL21554990 0.90 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1
SCHEMBL21555104 0.90 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1
SCHEMBL21526220 0.90 GPR139 (0.58) GPR139CTSLCTSSGPR132MEN1

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-3788031-B1 DIPEPTIDYL KETOAMIDE META-METHOXYPHENYL DERIVATIVES AND USES THEREOF LANDSTEINER GENMED S L (ES) 2023-09-27 EP disclosed
US-11242312-B2 Dipeptidyl ketoamide meta-methoxyphenyl derivatives and uses thereof LANDSTEINER GENMED, S.L. (ES) 2022-02-08 US disclosed
US-20210317075-A1 DIPEPTIDYL KETOAMIDE META-METHOXYPHENYL DERIVATIVES AND USES THEREOF LANDSTEINER GENMED, S.L. (ES) 2021-10-14 US disclosed
EP-3564211-A1 DIPEPTIDYL KETOAMIDE META-METHOXYPHENYL DERIVATIVES AND USES THEREOF LANDSTEINER GENMED, S.L. (ES) 2019-11-06 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-11242312-B2 Dipeptidyl ketoamide meta-methoxyphenyl derivatives and uses thereof DPP4, DPP7, DPP3 GPR139 3690/4885CTSL 150/4885CTSS 377/4885
US-20210317075-A1 DIPEPTIDYL KETOAMIDE META-METHOXYPHENYL DERIVATIVES AND USES THEREOF DPP4, DPP7, DPP3 GPR139 3690/4885CTSL 150/4885CTSS 377/4885

“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.