SCHEMBL21555036

SCHEMBL21555036

COc1cccc(C(=O)NC(C(=O)NC(Cc2ccccc2)C(=O)C(=O)NC2CC2)C(C)C)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 4/20 0.56
CAPN1 P07384 5/20 0.55
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPK1 P28482 1/20 0.48
CTSD P07339 1/20 0.45
BACE1 P56817 1/20 0.45
BACE2 Q9Y5Z0 1/20 0.45
GPR132 Q9UNW8 1/20 0.45
CTSL P07711 2/20 0.45

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
SCHEMBL23921539 1.00 GPR139 (0.56) GPR139CAPN1MEN1KMT2ALMNA
SCHEMBL21554794 1.00 GPR139 (0.56) GPR139CAPN1MEN1KMT2ALMNA
SCHEMBL21526187 1.00 GPR139 (0.56) GPR139CAPN1MEN1KMT2ALMNA
SCHEMBL21526228 0.89 CAPN1 (0.68) GPR139CAPN1MEN1KMT2AALDH1A1
SCHEMBL21526229 0.89 CAPN1 (0.68) GPR139CAPN1MEN1KMT2AALDH1A1
SCHEMBL21554807 0.89 CAPN1 (0.68) GPR139CAPN1MEN1KMT2AALDH1A1
SCHEMBL21555034 0.88 GPR139 (0.54) GPR139CAPN1MEN1KMT2ALMNA
SCHEMBL21554817 0.87 GPR139 (0.58) GPR139CAPN1MEN1KMT2AALDH1A1
SCHEMBL21526219 0.87 GPR139 (0.58) GPR139CAPN1MEN1KMT2AALDH1A1
SCHEMBL21555104 0.87 GPR139 (0.58) GPR139CAPN1MEN1KMT2AALDH1A1

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 7 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
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-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
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 3690/4885CAPN1 25/4885MEN1 4709/4885
US-20210317075-A1 DIPEPTIDYL KETOAMIDE META-METHOXYPHENYL DERIVATIVES AND USES THEREOF DPP4, DPP7, DPP3 GPR139 3690/4885CAPN1 25/4885MEN1 4709/4885

“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.