SCHEMBL7899015

SCHEMBL7899015

O=Cc1cccc2c1C=CC(=O)C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 4/20 0.46
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
THRB P10828 3/20 0.44
IDO1 P14902 3/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 3/20 0.44
MAPT P10636 3/20 0.44
RECQL P46063 3/20 0.44
LMNA P02545 2/20 0.44
HPGD P15428 2/20 0.44
ALOX15 P16050 2/20 0.44
HSD17B10 Q99714 2/20 0.44
POLB P06746 2/20 0.44
PTPN1 P18031 2/20 0.44
BCHE P06276 1/20 0.44
PKM P14618 1/20 0.44
ACHE P22303 1/20 0.44
CES1 P23141 1/20 0.44
PTPN22 Q9Y2R2 1/20 0.44

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
SCHEMBL5886239 0.72 PTPRC (0.53) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL10409093 0.72 MAPT (0.53) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL13445016 0.72 PTPRC (0.49) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL7900917 0.72 CDC25B (0.53) MEN1KMT2ATHRBIDO1ALDH1A1
SCHEMBL5886422 0.72 PTPRC (0.49) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL30496126 0.72 MAPT (0.53) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL8600436 0.72 PTPRC (0.49) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL5886509 0.72 PTPRC (0.49) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL27921312 0.69 PTPRC (0.46) PTPRCMEN1KMT2ATHRBIDO1
SCHEMBL9700287 0.69 KMT2A (0.48) MEN1KMT2ATHRBALDH1A1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265220-B1 NON-IMMUNOCHEMICAL METHOD BY REACTING A COMPOUND COMPRISING CIS-1,4-DIOXO-2-BUTENE MOIETY OR HYDROLYTICALLY DERIVED PRECURSOR WITH HOMOCYSTEINE, THEN DETECTING PRODUCT WITHOUT SEPARATION FROM LIQUID ULLMAN EDWIN F (US) 2001-07-24 US claimed
WO-2000000821-A1 ASSAY FOR HOMOCYSTEINE ULLMAN EDWIN F (US) 2000-01-06 WO claimed