SCHEMBL6151825

SCHEMBL6151825

CN1C=C[N+]=C1CCCNc1cc(NCCCn2cc[n+](C)c2)c(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.33
BCOR Q6W2J9 1/20 0.33
ALDH1A1 P00352 2/20 0.33
HTR6 P50406 1/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 4/20 0.32
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KAT2B Q92831 4/20 0.31
KMT2A Q03164 1/20 0.31
BCHE P06276 1/20 0.30
ACHE P22303 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL5718310 0.83 MAPT (0.38) BCL6BCORALDH1A1LMNAMAPT
SCHEMBL6151380 0.82 BCL6 (0.36) BCL6BCORALDH1A1LMNAMAPT
SCHEMBL5718354 0.78 MAPT (0.35) BCL6BCORALDH1A1LMNAMAPT
SCHEMBL5718321 0.78 LMNA (0.39) ALDH1A1HTR6LMNAMAPTPOLB
SCHEMBL5718267 0.77 MAPT (0.38) BCL6BCORALDH1A1LMNAMAPT
SCHEMBL7659809 0.76 LMNA (0.35) BCL6BCORALDH1A1LMNAMAPT
Sulfuric Acid SCHEMBL7668739 0.76 BCL6 (0.34) BCL6BCORALDH1A1LMNAMAPT
SCHEMBL5718533 0.76 MAPT (0.55) ALDH1A1LMNAMAPTPOLBPKM
SCHEMBL8095621 0.75 MEN1 (0.31) MAPTHTTSMN1; SMN2KMT2ARAB9A
Hydrochloric Acid SCHEMBL7721080 0.74 MEN1 (0.31) MAPTHTTSMN1; SMN2KMT2ARAB9A

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-1018508-B1 Cationic monobenzenic nitrophenylene diamines, their use for dyeing keratinic fibres, dye compositions containing them and dye processes OREAL (FR) 2005-05-04 EP disclosed
EP-1018508-A1 Cationic monobenzenic nitrophenylene diamines, their use for dyeing keratinic fibres, dye compositions containing them and dye processes L'OREAL (FR) 2000-07-12 EP disclosed