SCHEMBL2927862

SCHEMBL2927862

Cc1cc(N2CCC(n3cc[n+](CCCn4cc[n+](C5CCN(c6ccc(N)c(C)c6)C5)c4)c3)C2)ccc1N

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
RAD52 P43351 1/20 0.35

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 SCHEMBL6505708 0.99 GAA (0.34) GAARAD52
SCHEMBL2930250 0.97 GAA (0.34) GAARAD52
Hydrochloric Acid SCHEMBL6496555 0.96 GAA (0.33) GAARAD52
SCHEMBL2927488 0.88
Hydrochloric Acid SCHEMBL6495609 0.87
Bromide SCHEMBL6495700 0.87
SCHEMBL2922707 0.85 GAA (0.39) GAARAD52
Hydrochloric Acid SCHEMBL6505113 0.84 GAA (0.38) GAARAD52
SCHEMBL2956801 0.84
Hydrochloric Acid SCHEMBL6493736 0.83

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
EP-1728500-B1 Composition for dyeing keratinic fibres comprising a diamino-N,N-dihydro-pyrazolon derivative and a cationic oxidation dye OREAL (FR) 2010-01-27 EP disclosed
EP-1728500-A1 Composition for dyeing keratinic fibres comprising a diamino-N,N-dihydro-pyrazolon derivative and a cationic oxidation dye L'OREAL (FR) 2006-12-06 EP disclosed