SCHEMBL14445262

SCHEMBL14445262

CNc1c(N)cnn1CC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
KMO O15229 1/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 2/20 0.37
KDM4E B2RXH2 3/20 0.37
HSD17B10 Q99714 2/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 6/20 0.36
ALDH1A1 P00352 5/20 0.35
MAPT P10636 4/20 0.34
RAB9A P51151 4/20 0.34
NPC1 O15118 4/20 0.34
MITF O75030 3/20 0.34
S1PR4 O95977 1/20 0.34
S1PR1 P21453 1/20 0.34
POLB P06746 1/20 0.34
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL5424153 0.87 LMNA (0.35) LMNAKDM4ESMN1; SMN2ALDH1A1MAPT
SCHEMBL14445264 0.84 GAA (0.38) GAAKMOLMNATP53KDM4E
SCHEMBL14445269 0.82 KMO (0.40) GAAKMOLMNATP53KDM4E
SCHEMBL14445266 0.80 KMO (0.35) GAAKMOLMNATP53KDM4E
SCHEMBL14445271 0.80 KDM4C (0.36) GAAKMOLMNATP53KDM4E
SCHEMBL14445226 0.78 MEN1 (0.34) KMOKDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL1803279 0.77 LMNA (0.43) GAAKMOLMNATP53KDM4E
SCHEMBL4804121 0.76 CYP1A2 (0.36) GAACYP1A2
SCHEMBL6068728 0.75 GAA (0.41) GAAKMOLMNATP53KDM4E
SCHEMBL5416172 0.73 CDK1 (0.32)

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