SCHEMBL6933153

SCHEMBL6933153

COc1ccc(C2=NN(C)C(=O)C2(O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.42
MAPK1 P28482 1/20 0.42
MCL1 Q07820 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
BACE1 P56817 5/20 0.42
BACE2 Q9Y5Z0 2/20 0.42
ATM Q13315 1/20 0.41
PRMT5 O14744 4/20 0.40
WDR77 Q9BQA1 4/20 0.40
ME2 P23368 1/20 0.40
ME1 P48163 1/20 0.40
ME3 Q16798 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL6930299 0.82 BACE1 (0.49) BACE1BACE2CTSD
SCHEMBL6935629 0.82 APP (0.49) KMT2AKDM4EMEN1MAPTPKM
SCHEMBL6935411 0.81 MAOB (0.41) KMT2AKDM4EMEN1MAPTPKM
SCHEMBL6933851 0.81 PDE4A (0.41) KMT2AKDM4EMEN1MAPTPKM
SCHEMBL6931581 0.81 ALDH1A1 (0.42) KMT2AKDM4EMEN1MAPTPKM
SCHEMBL6930686 0.80 BACE1 (0.40) KMT2AMEN1BACE1BACE2ALDH1A1
SCHEMBL17290971 0.80 BACE1 (0.45) KMT2AKDM4EMEN1MAPTPKM
SCHEMBL17290756 0.80 BACE1 (0.39) KMT2AKDM4EMEN1MAPTPKM
SCHEMBL6931200 0.79 BACE1 (0.38) KDM4EMAPTBACE1BACE2ALDH1A1
SCHEMBL8491362 0.79 CES2 (0.47) KMT2AKDM4EMEN1MAPTBACE1

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