SCHEMBL6933636

SCHEMBL6933636

CC(C)N1N=C(c2cccs2)C(O)(O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
GAA P10253 3/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 8/20 0.36
ALDH1A1 P00352 6/20 0.36
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPT P10636 2/20 0.34
POLB P06746 1/20 0.34
THRB P10828 1/20 0.34
RECQL P46063 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM5B Q9UGL1 1/20 0.33
ERCC1 P07992 1/20 0.33
FEN1 P39748 1/20 0.33
ERCC4 Q92889 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 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
SCHEMBL6933850 0.81 HPGD (0.44) HPGDGAAMAPK1KDM4EALDH1A1
SCHEMBL6930598 0.77 HPGD (0.41) HPGDGAAMAPK1KDM4EALDH1A1
SCHEMBL6934098 0.77 HPGD (0.41) HPGDGAAMAPK1KDM4EALDH1A1
SCHEMBL6933627 0.76 PDE4A (0.41) GAAALDH1A1RAB9ASMN1; SMN2POLB
SCHEMBL6934231 0.75 ALDH1A1 (0.44) HPGDGAAKDM4EALDH1A1NPC1
SCHEMBL6935099 0.72 PDE4A (0.36) HPGDGAAMAPK1KDM4EALDH1A1
SCHEMBL6933851 0.69 PDE4A (0.41) HPGDGAAMAPK1KDM4EALDH1A1
SCHEMBL6928265 0.66 GAA (0.39) GAATDP1
SCHEMBL3734888 0.60 HPGD (0.51) HPGDGAAMAPK1KDM4EALDH1A1
SCHEMBL7468319 0.59 ALDH1A1 (0.50) HPGDGAAKDM4EALDH1A1NPC1

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