SCHEMBL6932783

SCHEMBL6932783

COc1ccc(N2N=C(c3cccc([N+](=O)[O-])c3)C(O)(O)C2=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
PKM P14618 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
NFE2L2 Q16236 2/20 0.45
KEAP1 Q14145 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
GAA P10253 1/20 0.43
PLG P00747 1/20 0.42
PLAU P00749 1/20 0.42
PLAT P00750 1/20 0.42

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
SCHEMBL6931599 0.89 KMT2A (0.46) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL6935614 0.89 ALDH1A1 (0.46) MAPTALDH1A1MEN1KMT2APKM
SCHEMBL6931194 0.89 MAPT (0.45) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL6931197 0.87 MEN1 (0.48) MAPTALDH1A1MEN1KMT2APKM
SCHEMBL6933114 0.86 CNR1 (0.46) MAPTALDH1A1NPSR1NFE2L2KEAP1
SCHEMBL6930303 0.85 LMNA (0.44) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL6932816 0.81 CES2 (0.44) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL6935629 0.80 APP (0.49) MAPTALDH1A1MEN1KMT2APKM
SCHEMBL6932694 0.80 MAPT (0.42) MAPTNPSR1NPC1RAB9ASMN1; SMN2
SCHEMBL6731991 0.79 MAPT (0.53) MAPTALDH1A1MEN1KMT2APKM

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