SCHEMBL2556052

SCHEMBL2556052

CC(=O)c1cccc(-c2cc(C(=O)O)cnc2O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDT P30046 1/20 0.48
MAP4K4 O95819 3/20 0.47
CLK4 Q9HAZ1 3/20 0.47
CSNK1G2 P78368 2/20 0.47
MKNK2 Q9HBH9 2/20 0.47
MAP4K5 Q9Y4K4 2/20 0.47
KDR P35968 2/20 0.45
MAPK8 P45983 2/20 0.45
CDK8 P49336 2/20 0.45
ACVR1 Q04771 2/20 0.45
MST1R Q04912 2/20 0.45
ROCK1 Q13464 2/20 0.45
LRRK2 Q5S007 2/20 0.45
DYRK1B Q9Y463 2/20 0.45
PLK4 O00444 1/20 0.45
DCLK1 O15075 1/20 0.45
ROCK2 O75116 1/20 0.45
PRKD3 O94806 1/20 0.45
PAK4 O96013 1/20 0.45
CHEK2 O96017 1/20 0.45

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
SCHEMBL2560018 0.84 HSD17B1 (0.46) MAP4K4CHEK2AXL
SCHEMBL2554294 0.79 TRIM24 (0.60) DDTMAP4K4CDK8DYRK1BCDK5
SCHEMBL2560542 0.78 LDHA (0.68) MAP4K4CLK4CSNK1G2MKNK2MAP4K5
SCHEMBL2562823 0.77 MAP4K4 (0.57) DDTMAP4K4CLK4CSNK1G2MKNK2
SCHEMBL2559953 0.76 DDT (0.50) DDTMAP4K4CLK4CSNK1G2MKNK2
SCHEMBL3015814 0.76 KMO (0.70) MAP4K4CLK4CSNK1G2MKNK2MAP4K5
SCHEMBL29951818 0.76 KMO (0.70) MAP4K4CLK4CSNK1G2MKNK2MAP4K5
SCHEMBL2558335 0.76 CNR2 (0.56) DDTKMOAKR1C3AKR1C2
SCHEMBL2556945 0.76 KMO (0.59) MAP4K4CLK4CSNK1G2MKNK2MAP4K5
SCHEMBL2943938 0.75 KMO (0.63) KMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed