SCHEMBL6936100

SCHEMBL6936100

CCCCCCCCN1NC(c2ccccc2)C(O)(O)C1=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.44
CNR2 P34972 3/20 0.38
CNR1 P21554 1/20 0.38
CDC25A P30304 1/20 0.38
MGLL Q99685 1/20 0.37
PPARG P37231 3/20 0.37
KCNH2 Q12809 1/20 0.37
SLC6A9 P48067 1/20 0.37
SLC6A5 Q9Y345 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ASAH1 Q13510 1/20 0.36
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 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
SCHEMBL6933858 0.76 ELANE (0.42) NPSR1
SCHEMBL6933521 0.76 GBA1 (0.38) FAAHCNR1MGLL
SCHEMBL7606899 0.71 FAAH (0.41) FAAHCNR2CNR1CDC25AKCNH2
SCHEMBL6931469 0.68 CA2 (0.35) KDM4ELMNA
SCHEMBL14560424 0.65 CNR2 (0.65) FAAHCNR2CNR1CDC25AMGLL
SCHEMBL428093 0.65 GBA1 (0.50) FAAHCNR2CNR1CDC25AMGLL
SCHEMBL30281303 0.64 NAAA (0.46) PPARGHTT
SCHEMBL22265963 0.64 LMNA (0.68) FAAHCNR2CNR1CDC25AMGLL
SCHEMBL7805517 0.62 NAAA (0.43) PPARG
SCHEMBL5754789 0.62 ALDH1A1 (0.51) KCNH2KDM4ELMNA

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