SCHEMBL21648449

SCHEMBL21648449

CC(C)CCNCCCNCCCNCc1cccc(-c2cc(-c3cccc(CNCCCNCCCNCCC(C)C)c3)cc(C(C)(C)C)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.41
▸ BACE1 P56817 1/20 0.41
▸ HTR1A P08908 2/20 0.40
▸ CHRM2 P08172 2/20 0.40
▸ SCN8A Q9UQD0 3/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ CA2 P00918 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MITF O75030 1/20 0.36
▸ GAA P10253 1/20 0.36

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 SCHEMBL29692391 0.99 BCHE (0.41) BCHEBACE1HTR1ACHRM2SCN8A
SCHEMBL21648451 0.94 BCHE (0.38) BCHEBACE1HTR1ACHRM2SCN8A
SCHEMBL21648351 0.90 BCHE (0.41) BCHEBACE1HTR1ACHRM2SCN8A
Hydrochloric Acid SCHEMBL29692416 0.89 BCHE (0.41) BCHEBACE1HTR1ACHRM2SCN8A
SCHEMBL21632587 0.89 HTR2A (0.33) BCHEBACE1HTR1AHDAC1
SCHEMBL21648323 0.83 BCHE (0.40) BCHEBACE1HTR1ACHRM2SCN8A
Hydrochloric Acid SCHEMBL29692596 0.82 BCHE (0.39) BCHEBACE1HTR1ACHRM2SCN8A
SCHEMBL21632659 0.82 BCHE (0.35) BCHEBACE1
SCHEMBL21648453 0.79 BCHE (0.37) BCHEBACE1HTR1ACHRM2SCN8A
SCHEMBL24720504 0.78 HTR1A (0.38) BCHEBACE1HTR1ACHRM2SCN8A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3606344-B1 COMPOSITIONS AND METHODS COMPRISING A TRIARYL POLYAMINE CURZA GLOBAL LLC (US) 2022-08-17 — — EP disclosed
US-11352315-B2 Compositions and methods comprising a triaryl polyamine CURZA GLOBAL, LLC (US) 2022-06-07 — — US disclosed
US-20200031757-A1 COMPOSITIONS AND METHODS COMPRISING A TRIARYL POLYAMINE CURZA GLOBAL, LLC (US) 2020-01-30 — — US 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-11352315-B2 Compositions and methods comprising a triaryl polyamine SRM, PARG, PARN BCHE 1877/4885BACE1 2824/4885HTR1A 3092/4885
US-20200031757-A1 COMPOSITIONS AND METHODS COMPRISING A TRIARYL POLYAMINE SRM, PARG, PARN BCHE 1877/4885BACE1 2824/4885HTR1A 3092/4885

“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.

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