SCHEMBL21648321

SCHEMBL21648321

CCCCCCNCCCNCCCNCc1cccc(-c2ccccc2-c2cccc(CNCCCNCCCNCCCCCC)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.59
CYP2D6 P10635 2/20 0.59
CYP2C19 P33261 2/20 0.59
CHRM2 P08172 3/20 0.53
HRH4 Q9H3N8 1/20 0.51
HRH3 Q9Y5N1 1/20 0.51
SIGMAR1 Q99720 1/20 0.50
SCN8A Q9UQD0 1/20 0.50
MAOA P21397 1/20 0.49
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
ACHE P22303 1/20 0.45

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 SCHEMBL29692481 0.99 CYP1A2 (0.62) CYP1A2CYP2D6CYP2C19CHRM2HRH4
Hydrochloric Acid SCHEMBL29692521 0.88 CYP1A2 (0.56) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL16436979 0.87 CYP1A2 (0.61) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL16436983 0.87 CYP1A2 (0.61) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL29864521 0.87 CYP1A2 (0.64) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL16264592 0.86 CYP1A2 (0.71) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL16264662 0.86 CYP1A2 (0.71) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL16264624 0.86 CYP1A2 (0.71) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL24720378 0.85 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19CHRM2HRH4
SCHEMBL21648307 0.85 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C19CHRM2HRH4

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 CYP1A2 3844/4885CYP2D6 4723/4885CYP2C19 3882/4885
US-20200031757-A1 COMPOSITIONS AND METHODS COMPRISING A TRIARYL POLYAMINE SRM, PARG, PARN CYP1A2 3844/4885CYP2D6 4723/4885CYP2C19 3882/4885

“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.