SCHEMBL6234260

SCHEMBL6234260

C[N+](C)(C)CCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCC[N+](C)(C)C)C5=O

nearest known ligand 0.87

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 6/20 0.87
▸ STAT3 P40763 1/20 0.63
▸ HIF1A Q16665 1/20 0.63
▸ KDM4E B2RXH2 1/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ RGS12 O14924 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ PABPC1 P11940 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51

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
SCHEMBL34460906 1.00 TERT (0.87) TERTSTAT3HIF1AKDM4EMEN1
Iodide SCHEMBL6230746 0.98 TERT (0.84) TERTSTAT3HIF1AKDM4EMEN1
Iodide SCHEMBL6232922 0.97 TERT (0.82) TERTSTAT3HIF1AKDM4EMEN1
SCHEMBL26378291 0.93 TERT (1.00) TERTKDM4EMEN1RGS12NPC1
SCHEMBL34460911 0.92 TERT (0.73) TERTSTAT3HIF1AKDM4EMEN1
SCHEMBL21367403 0.90 TERT (1.00) TERTSTAT3HIF1AKDM4EMEN1
Iodide SCHEMBL6233141 0.89 TERT (0.97) TERTSTAT3HIF1AKDM4EMEN1
SCHEMBL29923963 0.88 TERT (0.68) TERTSTAT3HIF1AKDM4EMEN1
Iodide SCHEMBL6234517 0.87 TERT (0.94) TERTSTAT3HIF1AKDM4EMEN1
Iodide SCHEMBL6231774 0.85 TERT (0.64) TERTSTAT3HIF1AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1027879-B1 Use of cationic condensed polycyclic compounds for dyeing of keratinic substances, dyeing compositions and process OREAL (FR) 2005-04-20 — — EP claimed
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