SCHEMBL14445239

SCHEMBL14445239

CC(C(=O)O)n1ncc(N)c1N

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 3/20 0.37
KMT2A Q03164 1/20 0.36
PRNP P04156 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32
GRIA3 P42263 1/20 0.32
GRIA4 P48058 1/20 0.32
POLB P06746 1/20 0.31

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
SCHEMBL14445200 0.85 MEN1 (0.36) ALDH1A1KMT2A
SCHEMBL14445241 0.77 KMO (0.49) ALDH1A1KDM4EHPGDPOLB
SCHEMBL14321038 0.76
SCHEMBL94060 0.76
SCHEMBL144678 0.76 PIK3CD (0.30) KDM4E
SCHEMBL5447180 0.75 CYP1A2 (0.39) ALDH1A1KDM4EHPGDGRIA1GRIA2
Sulfuric Acid SCHEMBL2921878 0.74 FPR1 (0.32) KDM4E
SCHEMBL4730392 0.74
SCHEMBL14445198 0.74 KMO (0.37) ALDH1A1KDM4E
Sulfuric Acid SCHEMBL143343 0.73

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
US-7250063-B2 Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres L'OREAL (FR) 2007-07-31 US disclosed
US-7250063-B2 Diaminopyrazole derivatives and their use for oxidation dyeing of keratinous fibres L'OREAL (FR) 2007-07-31 US disclosed