SCHEMBL6931200

SCHEMBL6931200

CN1N=C(c2ccncc2)C(O)(O)C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 6/20 0.38
BACE2 Q9Y5Z0 5/20 0.38
GAA P10253 1/20 0.35
AURKA O14965 1/20 0.35
TTK P33981 1/20 0.35
AURKB Q96GD4 1/20 0.35
INCENP Q9NQS7 1/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
CTSD P07339 3/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
CCNC P24863 1/20 0.34
CDK8 P49336 1/20 0.34
CYP19A1 P11511 2/20 0.34
AR P10275 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
F12 P00748 1/20 0.33
HPGD P15428 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
SCHEMBL6930686 0.84 BACE1 (0.40) BACE1BACE2GAACTSDALDH1A1
SCHEMBL6933471 0.83 ALDH1A1 (0.33) ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL6933153 0.79 KMT2A (0.42) BACE1BACE2CTSDALDH1A1KDM4E
SCHEMBL6930205 0.72 COMT (0.40) ALDH1A1MAPTSMN1; SMN2
SCHEMBL6933850 0.72 HPGD (0.44) GAAALDH1A1KDM4ELMNAMAPT
SCHEMBL6930299 0.71 BACE1 (0.49) BACE1BACE2GAACTSDLMNA
SCHEMBL6933141 0.69 PGR (0.43) ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL6933167 0.69 KMT2A (0.39) ALDH1A1KDM4ELMNAMAPTHPGD
SCHEMBL7264592 0.67 AURKA (0.37) BACE1BACE2AURKATTKAURKB
SCHEMBL6164620 0.67 BACE1 (0.37) BACE1BACE2AURKBCTSD

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 6 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 claimed
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-A1 4,4-Dihydroxypyrazolin-5-one compounds, procedures for their preparation and their use as cosmetics L'OREAL (FR) 1999-03-24 EP 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