SCHEMBL6935223

SCHEMBL6935223

O=C1N(c2ccccc2)N=C(c2ccc([N+](=O)[O-])cc2)C1(O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.48
KMT2A Q03164 11/20 0.48
MAPT P10636 10/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 8/20 0.46
KDM4E B2RXH2 4/20 0.46
HTT P42858 4/20 0.45
LMNA P02545 4/20 0.45
NPC1 O15118 4/20 0.45
MCOLN3 Q8TDD5 1/20 0.45
RAB9A P51151 3/20 0.42
ALOX12 P18054 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
AURKA O14965 1/20 0.41
MAPK1 P28482 2/20 0.41
POLB P06746 2/20 0.41

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
SCHEMBL6933095 0.95 MAPT (0.54) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL6935518 0.88 ACHE (0.46) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL6931466 0.84 SMN1; SMN2 (0.41) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL6931197 0.84 MEN1 (0.48) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6931194 0.84 MAPT (0.45) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL6930285 0.82 SMN1; SMN2 (0.43) MEN1KMT2AMAPTGAASMN1; SMN2
SCHEMBL6931599 0.78 KMT2A (0.46) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL8491362 0.77 CES2 (0.47) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL6935614 0.77 ALDH1A1 (0.46) MEN1KMT2AMAPTL3MBTL1GAA
SCHEMBL8489121 0.76 APP (0.43) MEN1KMT2AMAPTL3MBTL1GAA

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