SCHEMBL6934787

SCHEMBL6934787

CCCCCCCCN1N=CC(O)(O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.41
PTGS2 P35354 3/20 0.41
MGLL Q99685 3/20 0.41
FAAH O00519 3/20 0.41
KDM4E B2RXH2 2/20 0.40
HTT P42858 2/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 3/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
POLB P06746 1/20 0.39
SCN9A Q15858 2/20 0.37
GBA1 P04062 2/20 0.36
TP53 P04637 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CYP3A4 P08684 1/20 0.36
G6PD P11413 1/20 0.36
HPGD P15428 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
SCHEMBL7607800 0.67 MGLL (0.44) PTGS1PTGS2MGLLFAAHKDM4E
SCHEMBL6532264 0.63 ALDH1A1 (0.50) PTGS1PTGS2MGLLFAAHKDM4E
SCHEMBL30982886 0.61 PTGS1 (0.46) PTGS1PTGS2MGLLFAAHKDM4E
SCHEMBL30982585 0.61 PTGS1 (0.46) PTGS1PTGS2MGLLFAAHKDM4E
SCHEMBL30983013 0.61 PTGS1 (0.46) PTGS1PTGS2MGLLFAAHKDM4E
SCHEMBL13966396 0.59 MGLL (0.64) PTGS1PTGS2MGLLFAAHHTT
SCHEMBL13681576 0.59 MGLL (0.64) PTGS1PTGS2MGLLFAAHHTT
SCHEMBL9626274 0.59 MGLL (0.52) PTGS1PTGS2MGLLFAAHHTT
SCHEMBL11840543 0.59 MGLL (0.52) PTGS1PTGS2MGLLFAAHHTT
SCHEMBL12787622 0.59 MGLL (0.52) PTGS1PTGS2MGLLFAAHHTT

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