SCHEMBL23215565

SCHEMBL23215565

NC(c1cc(Cl)c(Cl)cc1OC(=O)C(F)(F)F)C1CCN(CC(F)F)CC1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.33
DPP7 Q9UHL4 4/20 0.32
KCNH2 Q12809 2/20 0.31
CACNA1I Q9P0X4 1/20 0.31
DYRK1A Q13627 1/20 0.31
DPP8 Q6V1X1 1/20 0.31
DPP9 Q86TI2 1/20 0.31
HRH1 P35367 1/20 0.31
CCR3 P51677 1/20 0.31
HTR4 Q13639 1/20 0.31
CXCR2 P25025 1/20 0.30
PIK3CA P42336 1/20 0.30
MTOR P42345 1/20 0.30
EPHX1 P07099 1/20 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
SCHEMBL23214994 0.88 ACHE (0.40) KCNH2HRH1CCR3HTR4
SCHEMBL23215346 0.86 DPP4 (0.34) DPP4DPP7CACNA1IDPP8DPP9
SCHEMBL23216733 0.86 DPP4 (0.32) DPP4HTR4PIK3CAMTOR
SCHEMBL23216090 0.85 CPN1 (0.36) DPP4DPP7DPP8DPP9
SCHEMBL23215569 0.85 CHRM3 (0.42) KCNH2
SCHEMBL23216009 0.83 SMYD3 (0.39) DPP4DPP7DPP8DPP9
SCHEMBL23216213 0.83 SMYD3 (0.39) DPP4DPP7DPP8DPP9
SCHEMBL23216624 0.83 DPP4 (0.38) DPP4DPP7DPP8DPP9HTR4
Trifluoroacetic Acid SCHEMBL23215564 0.82 DPP4 (0.40) DPP4DPP7DPP8DPP9
SCHEMBL23215612 0.80 SLC6A4 (0.40) DPP4HTR4

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 DPP4 2667/4885DPP7 1535/4885KCNH2 5/4885

“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.