SCHEMBL2558804

SCHEMBL2558804

O=Cc1cccc(-c2ccc(C(=O)O)nc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.60
TRIM33 Q9UPN9 1/20 0.60
CDK8 P49336 1/20 0.48
UNG P13051 1/20 0.47
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
AXL P30530 1/20 0.44
MAP4K4 O95819 1/20 0.44
DDT P30046 1/20 0.43
P4HTM Q9NXG6 3/20 0.43
P4HA1 P13674 1/20 0.42
MIF P14174 1/20 0.42
DYRK1A Q13627 2/20 0.42
DYRK2 Q92630 2/20 0.42
DYRK1B Q9Y463 2/20 0.42
DYRK3 O43781 1/20 0.42

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
SCHEMBL2559107 0.82 P4HTM (0.53) TRIM24TRIM33MAP4K4P4HTMP4HA1
SCHEMBL2558686 0.81 TRIM24 (0.59) TRIM24TRIM33CDK8UNGCA12
SCHEMBL28563936 0.80 DDT (0.61) AXLMAP4K4DDTP4HTMP4HA1
SCHEMBL29772925 0.80 DDT (0.61) AXLMAP4K4DDTP4HTMP4HA1
SCHEMBL486067 0.80 KMO (0.59) CYP4F2CYP4A11MAP4K4P4HTMP4HA1
SCHEMBL3637178 0.80 HSD17B1 (0.60) CYP4F2CYP4A11MAP4K4P4HTMP4HA1
SCHEMBL29929320 0.78 HIF1A (0.55) MAP4K4P4HTMP4HA1MIFKDM4E
SCHEMBL71034 0.78 HIF1A (0.55) MAP4K4P4HTMP4HA1MIFKDM4E
SCHEMBL21552113 0.78 EGLN1 (0.58) MAP4K4P4HTMKMO
SCHEMBL13680500 0.78 KMO (0.57) CYP4F2CYP4A11MAP4K4P4HTMP4HA1

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