SCHEMBL6930598

SCHEMBL6930598

CCN1N=C(c2cccs2)C(O)(O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
ADORA1 P30542 2/20 0.39
GAA P10253 4/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 9/20 0.36
KDM4E B2RXH2 7/20 0.36
MAPT P10636 4/20 0.36
HTT P42858 3/20 0.36
RCE1 Q9Y256 1/20 0.36
RAB9A P51151 4/20 0.36
LMNA P02545 3/20 0.36
KEAP1 Q14145 1/20 0.36
KMT2A Q03164 6/20 0.36
MEN1 O00255 5/20 0.36
NPSR1 Q6W5P4 2/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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) HPGDADORA1GAAMAPK1ALDH1A1
SCHEMBL6934098 0.77 HPGD (0.41) HPGDGAAMAPK1ALDH1A1KDM4E
SCHEMBL6933636 0.77 HPGD (0.41) HPGDGAAMAPK1ALDH1A1KDM4E
SCHEMBL6934231 0.75 ALDH1A1 (0.44) HPGDGAAALDH1A1KDM4EMAPT
SCHEMBL6934809 0.71 ELANE (0.37) HPGDALDH1A1KDM4EMAPTRAB9A
SCHEMBL7604849 0.69 ADORA1 (0.41) HPGDADORA1GAAALDH1A1KDM4E
SCHEMBL6935248 0.63
SCHEMBL6934260 0.61 KDM4E (0.33) GAAMAPK1ALDH1A1KDM4EMAPT
SCHEMBL6934450 0.61 ALOX15 (0.31) SMN1; SMN2
SCHEMBL3734888 0.60 HPGD (0.51) HPGDGAAMAPK1ALDH1A1KDM4E

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