SCHEMBL7499466

SCHEMBL7499466

CCOC(=O)c1cn(C2CC2)c2c(OC)c(-c3cc(F)c4c(c3)CN(S(=O)(=O)c3ccc(C)cc3)C4)ccc2c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
KCNH2 Q12809 5/20 0.37
GSK3B P49841 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
POLB P06746 1/20 0.36
PRKD3 O94806 1/20 0.36
ALOX15 P16050 1/20 0.36
OPRM1 P35372 1/20 0.36
CLK2 P49760 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL7500976 0.93 ADRB2 (0.38) ADRB2HPGDMEN1KMT2AMAPT
SCHEMBL7499418 0.92 ADRB2 (0.41) ADRB2HPGDMEN1KMT2AMAPT
SCHEMBL7495686 0.92 KCNH2 (0.44) HPGDMEN1KMT2AKCNH2GSK3B
SCHEMBL7497474 0.89 ADRB2 (0.40) ADRB2HPGDMEN1KMT2AMAPT
SCHEMBL7498890 0.89 ADRB2 (0.41) ADRB2HPGDMEN1KMT2AMAPT
SCHEMBL7503192 0.88 HPGD (0.37) ADRB2HPGDMEN1KMT2AMAPT
SCHEMBL7506840 0.84 TOP2A (0.40) HPGDMEN1KMT2AKCNH2GSK3B
SCHEMBL7012706 0.83 ADRB2 (0.45) ADRB2HPGDMEN1KMT2AMAPT
SCHEMBL7010122 0.83 ADRB2 (0.43) ADRB2HPGDMEN1KMT2AMAPT
SCHEMBL7509004 0.83 ADRB2 (0.44) ADRB2HPGDMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882725-B1 QUINOLONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2002-12-18 EP disclosed
US-6025370-A METHICILLIN-RESISTANT STAPHYLOCOCCUS AUREUS TOYAMA CHEMICAL CO., LTD. (JP) 2000-02-15 US disclosed
EP-0882725-A1 QUINOLONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 1998-12-09 EP disclosed