SCHEMBL6930679

SCHEMBL6930679

CCOC(=O)C1NN(CC)C(=O)C1(O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.34
KDM4E B2RXH2 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 2/20 0.33
TSHR P16473 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 5/20 0.33
HTT P42858 1/20 0.33
GAA P10253 3/20 0.32
HSD17B10 Q99714 2/20 0.32
CACNA1F O60840 1/20 0.32
CACNA1D Q01668 1/20 0.32
CACNA1S Q13698 1/20 0.32
CACNA1C Q13936 1/20 0.32
HPGD P15428 1/20 0.32
POLB P06746 1/20 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
SCHEMBL6934817 0.83 ELANE (0.35) ELANEKDM4EMEN1KMT2AMAPT
SCHEMBL6935664 0.79 MAPT (0.40) ELANEKDM4EMEN1KMT2AMAPT
SCHEMBL6933827 0.75 MEN1 (0.42) KDM4EMEN1KMT2AMAPTTSHR
SCHEMBL7606908 0.69 MAPT (0.42) KDM4EMEN1KMT2AMAPTCYP1A2
SCHEMBL6934455 0.66
SCHEMBL30063005 0.61 MAPT (0.38) KDM4EMEN1KMT2AMAPTTSHR
SCHEMBL31552080 0.60 ALDH1A1 (0.38) KDM4EMEN1KMT2AMAPTTSHR
SCHEMBL23727906 0.60 ALDH1A1 (0.38) KDM4EMEN1KMT2AMAPTTSHR
SCHEMBL9729236 0.60 ALDH1A1 (0.45) KDM4EMEN1KMT2AMAPTTSHR
SCHEMBL9729226 0.60 ALDH1A1 (0.45) KDM4EMEN1KMT2AMAPTTSHR

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-0903342-B1 4,4-Dihydroxypyrazolin-5-one compounds, procedures for their preparation and their use as cosmetics OREAL (FR) 2003-12-17 EP disclosed
EP-0903342-A1 4,4-Dihydroxypyrazolin-5-one compounds, procedures for their preparation and their use as cosmetics L'OREAL (FR) 1999-03-24 EP disclosed