SCHEMBL5406445

SCHEMBL5406445

Nc1cnn(CC(O)C(O)C(O)CO)c1NCC(O)C(O)C(O)CO

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.30
MAPK1 P28482 2/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
GAA P10253 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
SCHEMBL14357642 0.90 KDM4E (0.31) KDM4EMAPTMAPK1MEN1LMNA
SCHEMBL5409853 0.89
SCHEMBL14357666 0.89 KDM4E (0.30) KDM4EMAPTMAPK1MEN1LMNA
SCHEMBL5399955 0.88
SCHEMBL5405338 0.88 KDM4E (0.33) KDM4EMAPTMAPK1MEN1LMNA
SCHEMBL5401359 0.85 KDM4E (0.32) KDM4EMAPTMAPK1MEN1LMNA
SCHEMBL5408705 0.81
SCHEMBL5410013 0.80
SCHEMBL5447124 0.80
SCHEMBL5406459 0.80 KDM4E (0.33) KDM4EMAPTMAPK1MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US claimed
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US disclosed
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US disclosed
US-7300469-B2 Diaminopyrazole compounds and the use thereof in the oxidation dyeing of keratinous fibres L'OREAL, SA (FR) 2007-11-27 US disclosed