SCHEMBL21554935

SCHEMBL21554935

COC(=O)C(O)C(Cc1ccccc1)NC(=O)[C@@H](N)CC1CC1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
REN P00797 8/20 0.47
LTA4H P09960 1/20 0.46
PYGL P06737 1/20 0.45
METAP2 P50579 1/20 0.44
METAP1 P53582 1/20 0.44
CTSD P07339 1/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
OPRK1 P41145 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
Hydrochloric Acid SCHEMBL21526200 0.99 REN (0.47) RENLTA4HPYGLMETAP2METAP1
Hydrochloric Acid SCHEMBL21526201 0.99 REN (0.47) RENLTA4HPYGLMETAP2METAP1
Hydrochloric Acid SCHEMBL20474494 0.84 BACE1 (0.46) RENLTA4HMETAP2METAP1
Hydrochloric Acid SCHEMBL20474493 0.84 BACE1 (0.46) RENLTA4HMETAP2METAP1
SCHEMBL28519747 0.84 TDP1 (0.44) LTA4HMETAP2METAP1CTSD
SCHEMBL21554938 0.84 TDP1 (0.44) LTA4HMETAP2METAP1CTSD
SCHEMBL21554937 0.84 TDP1 (0.44) LTA4HMETAP2METAP1CTSD
Hydrochloric Acid SCHEMBL21526213 0.83 TDP1 (0.43) LTA4HMETAP2METAP1CTSD
Hydrochloric Acid SCHEMBL21526212 0.83 TDP1 (0.43) LTA4HMETAP2METAP1CTSD
SCHEMBL21554934 0.81 REN (0.37) RENMETAP2METAP1

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 REN 41/4885LTA4H 3183/4885PYGL 115/4885
US-20210317075-A1 DIPEPTIDYL KETOAMIDE META-METHOXYPHENYL DERIVATIVES AND USES THEREOF DPP4, DPP7, DPP3 REN 41/4885LTA4H 3183/4885PYGL 115/4885

“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.