SCHEMBL23215330

SCHEMBL23215330

N[C@@H](c1cc(Cl)c(Cl)cc1OC(=O)C(F)(F)F)C1CCN(C(=O)C2CNC(=O)NC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.35
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
LMNA P02545 1/20 0.32
CNR1 P21554 2/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
DPP4 P27487 3/20 0.31
DPP7 Q9UHL4 2/20 0.30

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
SCHEMBL23215675 0.92 MGLL (0.35) MGLLKMT2AMEN1LMNACNR1
SCHEMBL23216075 0.91 MGLL (0.36) MGLLKMT2AMEN1LMNACNR1
SCHEMBL23215940 0.90 TACR3 (0.39) MGLLKMT2AMEN1LMNACNR1
SCHEMBL23215038 0.89 MGLL (0.38) MGLL
SCHEMBL23216325 0.88 CCR4 (0.35) MGLLKMT2AMEN1LMNADPP4
SCHEMBL23215237 0.88 CCR4 (0.35) MGLLKMT2AMEN1LMNADPP4
Trifluoroacetic Acid SCHEMBL23215332 0.84 DPP4 (0.36) MGLLCNR1NPSR1DPP4DPP7
Trifluoroacetic Acid SCHEMBL23215328 0.84 DPP4 (0.36) MGLLCNR1NPSR1DPP4DPP7
SCHEMBL23215346 0.83 DPP4 (0.34) CNR1DPP4DPP7
SCHEMBL23230903 0.82 CNR1 (0.37) MGLLKMT2ACNR1TSHRNPSR1

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 3399/4885KMT2A 229/4885MEN1 1151/4885

“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.