SCHEMBL6930677

SCHEMBL6930677

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
CYP1A2 P05177 2/20 0.38
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 2/20 0.34
MEN1 O00255 1/20 0.34
ALOX15 P16050 1/20 0.34
KMT2A Q03164 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 3/20 0.33
PDE4D Q08499 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL6933819 0.85 SMN1; SMN2 (0.34) HSD17B10GAAALDH1A1
SCHEMBL6935349 0.80 KMT2A (0.30) KMT2A
SCHEMBL6935660 0.78 CYP1A2 (0.36) ELANECYP1A2CA12CA1CA2
SCHEMBL6928263 0.71 PDE4D (0.48) ELANECYP1A2HSD17B10KDM4EMAPT
SCHEMBL6933587 0.69
SCHEMBL7606902 0.67 HSD17B10 (0.39) CYP1A2CA12CA1CA2CA7
SCHEMBL17548930 0.64 ALDH1A1 (0.40) CYP1A2HSD17B10KDM4EMAPTTSHR
SCHEMBL6935471 0.62 NPSR1 (0.34) CA12CA1CA2CA7CA9
SCHEMBL6935431 0.59 KDM4E (0.32) KDM4EMAPTGAAALDH1A1
SCHEMBL11008658 0.58 ALDH1A1 (0.62) CA12CA1CA2CA7CA9

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-5958382-A ARTIFICIAL TANNING AND/OR COLORING OF HUMAN SKIN AND/OR HAIR SOCIETE L'OREAL S.A. (FR) 1999-09-28 US claimed
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
US-5958382-A ARTIFICIAL TANNING AND/OR COLORING OF HUMAN SKIN AND/OR HAIR SOCIETE L'OREAL S.A. (FR) 1999-09-28 US 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