SCHEMBL5196485

SCHEMBL5196485

Cn1ccc(=NN=CN=Nc2n(C)cc[n+]2C)cc1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.32

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 SCHEMBL4805084 0.99 HDAC8 (0.31) HDAC8
SCHEMBL483981 0.81 HDAC8 (0.34) HDAC8
SCHEMBL483985 0.81 HDAC8 (0.34) HDAC8
Hydrochloric Acid SCHEMBL1151781 0.80 HDAC8 (0.33) HDAC8
Hydrochloric Acid SCHEMBL1151784 0.80 HDAC8 (0.33) HDAC8
SCHEMBL5197895 0.78 KDM4E (0.45) HDAC8
Hydrochloric Acid SCHEMBL4799280 0.77 KDM4E (0.44)
SCHEMBL5197623 0.77
Hydrochloric Acid SCHEMBL4809867 0.76
SCHEMBL5199374 0.74 HDAC8 (0.31) HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1548006-B1 Synthesis of tetraazapentamethine derivatives, keratin fibers dyeing process which uses such synthesis OREAL (FR) 2007-09-05 EP claimed
EP-1548006-A1 Synthesis of tetraazapentamethine derivatives, keratin fibers dyeing process which uses such synthesis L'OREAL (FR) 2005-06-29 EP claimed
EP-1378544-A2 Tetraaza-pentamethine derivatives and their application for dyeing keratinous fibres L'OREAL (FR) 2004-01-07 EP claimed
EP-1548006-B1 Synthesis of tetraazapentamethine derivatives, keratin fibers dyeing process which uses such synthesis OREAL (FR) 2007-09-05 EP disclosed
EP-1548006-A1 Synthesis of tetraazapentamethine derivatives, keratin fibers dyeing process which uses such synthesis L'OREAL (FR) 2005-06-29 EP disclosed
EP-1378544-A2 Tetraaza-pentamethine derivatives and their application for dyeing keratinous fibres L'OREAL (FR) 2004-01-07 EP disclosed