SCHEMBL6934098

SCHEMBL6934098

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.41
CA12 O43570 2/20 0.39
CA9 Q16790 2/20 0.39
GAA P10253 2/20 0.36
MAPK1 P28482 2/20 0.36
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 9/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 8/20 0.33
SMN1; SMN2 Q16637 5/20 0.33
HSD17B10 Q99714 3/20 0.33
MAPT P10636 2/20 0.33
USP2 O75604 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33
HTT P42858 1/20 0.33
CASP7 P55210 1/20 0.33
ERCC1 P07992 1/20 0.33
FEN1 P39748 1/20 0.33
ERCC4 Q92889 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) HPGDGAAMAPK1KMT2AALDH1A1
SCHEMBL6930598 0.77 HPGD (0.41) HPGDGAAMAPK1KMT2AALDH1A1
SCHEMBL6933636 0.77 HPGD (0.41) HPGDGAAMAPK1ALDH1A1LMNA
SCHEMBL6934231 0.75 ALDH1A1 (0.44) HPGDGAAKMT2AALDH1A1LMNA
SCHEMBL7613399 0.69 CA12 (0.41) HPGDCA12CA9GAAMAPK1
SCHEMBL6933828 0.69 COMT (0.34) ALDH1A1SMN1; SMN2MAPTNPC1RAB9A
SCHEMBL14559414 0.68 CA12 (0.40) CA12CA9GAAMAPK1KMT2A
SCHEMBL3734888 0.60 HPGD (0.51) HPGDGAAMAPK1KMT2AALDH1A1
SCHEMBL4933930 0.58 SLC6A11 (0.54) CA9MAPK1ALDH1A1CASP1HDAC3
SCHEMBL7615015 0.57 GABRA1 (0.40) HPGDKMT2AALDH1A1KDM4ESMN1; SMN2

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