SCHEMBL23216837

SCHEMBL23216837

C=CCOc1ccc(Cl)c(Cl)c1C(O)C1CCCN(C(=O)[C@H]2CCN(C(=O)O)C2)CC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.36
PARP1 P09874 1/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL29745537 0.89 HPGD (0.41) MEN1KMT2AMAPTPARP1ALDH1A1
SCHEMBL23214820 0.82 SMN1; SMN2 (0.42) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23216642 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23216137 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23216825 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23216140 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23216947 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23216443 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL23216448 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL29745354 0.82 ALDH1A1 (0.38) MEN1KMT2AKDM4EALDH1A1HPGD

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 MEN1 1151/4885KMT2A 229/4885MAPT 3809/4885

“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.