SCHEMBL20524265

SCHEMBL20524265

CC[n+]1cccc(-c2nc(-c3ccc[n+](CC)c3)nc(-c3ccc[n+](CC)c3)n2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
PKM P14618 1/20 0.53
APOBEC3A P31941 1/20 0.53
APOBEC3G Q9HC16 1/20 0.53
LMNA P02545 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
CHRNA7 P36544 6/20 0.34
CHRNA10 Q9GZZ6 6/20 0.34
CHRNA9 Q9UGM1 6/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 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
SCHEMBL2737196 0.85 KDM4E (0.51) KDM4EPKMAPOBEC3AAPOBEC3GLMNA
SCHEMBL28333949 0.79 LMNA (0.60) KDM4EPKMAPOBEC3AAPOBEC3GLMNA
SCHEMBL5953790 0.78 LMNA (0.48) KDM4EPKMAPOBEC3AAPOBEC3GLMNA
Bromide SCHEMBL10428847 0.78 LMNA (0.58) KDM4EPKMAPOBEC3AAPOBEC3GLMNA
SCHEMBL20524228 0.74 TERT (0.46) KDM4EPKMAPOBEC3AAPOBEC3GLMNA
SCHEMBL20524229 0.72 TERT (0.47) APOBEC3AAPOBEC3GLMNAL3MBTL1CYP1A2
SCHEMBL29556923 0.70
SCHEMBL294294 0.70
SCHEMBL9091930 0.70 KDM4E (0.44) KDM4EPKMAPOBEC3AAPOBEC3GLMNA
SCHEMBL5286663 0.69 APOBEC3A (0.36) KDM4EPKMAPOBEC3AAPOBEC3GLMNA

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
WO-2018183749-A1 TRIAZINIUM CATION FORMS AND METHODS OF MAKING THEREOF LOYOLA UNIVERSITY NEW ORLEANS (US) 2018-10-04 WO claimed
US-10961224-B2 Triazinium cation forms and methods of making thereof LOYOLA UNIVERSITY NEW ORLEANS (US) 2021-03-30 US disclosed
WO-2018183749-A1 TRIAZINIUM CATION FORMS AND METHODS OF MAKING THEREOF LOYOLA UNIVERSITY NEW ORLEANS (US) 2018-10-04 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-10961224-B2 Triazinium cation forms and methods of making thereof MITF, SOD1, TYR KDM4E 2914/4885PKM 2069/4885APOBEC3A 1963/4885

“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.