SCHEMBL10118540

SCHEMBL10118540

CC(C(=O)c1ccco1)c1ccco1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.65
POLB P06746 4/20 0.65
MEN1 O00255 3/20 0.65
AGTR1 P30556 1/20 0.65
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
PTPN1 P18031 2/20 0.47
ALOX5 P09917 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
THRB P10828 1/20 0.46
APEX1 P27695 1/20 0.46
RECQL P46063 1/20 0.46
PKM P14618 1/20 0.46
PTPN7 P35236 1/20 0.46
BLM P54132 1/20 0.46
ESR2 Q92731 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 2/20 0.44
MIF P14174 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
SCHEMBL1107037 0.82 KMT2A (0.60) KMT2APOLBMEN1AGTR1CES2
SCHEMBL2526234 0.80 KMT2A (0.63) KMT2APOLBMEN1AGTR1CES2
SCHEMBL27536602 0.79 KMT2A (0.52) KMT2APOLBMEN1AGTR1CES2
SCHEMBL155225 0.78 KMT2A (1.00) KMT2APOLBMEN1AGTR1CES2
SCHEMBL27562774 0.78 KMT2A (0.56) KMT2APOLBMEN1AGTR1CES2
SCHEMBL5747190 0.78 KMT2A (0.56) KMT2APOLBMEN1AGTR1CES2
SCHEMBL11318423 0.78 KMT2A (0.56) KMT2APOLBMEN1AGTR1CES2
SCHEMBL2480787 0.78 KMT2A (0.61) KMT2APOLBMEN1AGTR1CES2
SCHEMBL11538261 0.78 KMT2A (0.52) KMT2APOLBMEN1AGTR1CES2
SCHEMBL17111051 0.77 KMT2A (0.96) KMT2APOLBMEN1AGTR1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012021707-A2 PREMATURE-TERMINATION-CODONS READTHROUGH COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-16 WO disclosed