SCHEMBL23215550

SCHEMBL23215550

N[C@@H](c1cc(Cl)c(Cl)cc1OC(=O)C(F)(F)F)C1CCN(C(=O)[C@@H]2CNC(=O)CO2)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.32

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
SCHEMBL23216075 0.85 MGLL (0.36) MGLL
Trifluoroacetic Acid SCHEMBL23215548 0.85 DPP4 (0.34) MGLL
Trifluoroacetic Acid SCHEMBL23215552 0.85 DPP4 (0.34) MGLL
SCHEMBL23215940 0.84 TACR3 (0.39) MGLL
SCHEMBL23215699 0.84 SMYD3 (0.33) MGLL
SCHEMBL23216780 0.84 SMYD3 (0.33) MGLL
SCHEMBL23215694 0.84 SMYD3 (0.33) MGLL
SCHEMBL23215696 0.84 SMYD3 (0.33) MGLL
SCHEMBL23216770 0.84 SMYD3 (0.33) MGLL
SCHEMBL29745142 0.84 SMYD3 (0.33) MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230023559-A1 ARYLMETHYLENE HETEROCYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC (US) 2023-01-26 US disclosed
WO-2021071806-A1 ARYLMETHYLENE HETEROCYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC (US) 2021-04-15 WO 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-20230023559-A1 ARYLMETHYLENE HETEROCYCLIC COMPOUNDS AS KV1.3 POTASSIUM SHAKER CHANNEL BLOCKERS KCNJ2, KCNA3, KCNH3 MGLL 3399/4885

“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.