SCHEMBL2558026

SCHEMBL2558026

COc1ncc(-c2cccc(C=O)c2)cc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.49
TRIM33 Q9UPN9 1/20 0.49
CDK8 P49336 1/20 0.45
MAPT P10636 1/20 0.43
CASP1 P29466 1/20 0.43
AXL P30530 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CYP2C9 P11712 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
UNG P13051 1/20 0.41
PIK3C3 Q8NEB9 1/20 0.41
MAP3K5 Q99683 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
DYRK1A Q13627 2/20 0.38
DYRK2 Q92630 2/20 0.38
DYRK1B Q9Y463 2/20 0.38
ERN1 O75460 1/20 0.38
DYRK3 O43781 1/20 0.38
CCNT1 O60563 1/20 0.38

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
SCHEMBL2554054 0.85 DHODH (0.43) TRIM24TRIM33MAPTCASP1AXL
SCHEMBL14931747 0.83 MAPT (0.59) MAPTCASP1AXLPIK3C3TDP1
SCHEMBL2553500 0.81 TRIM24 (0.54) TRIM24TRIM33CDK8AXLUNG
SCHEMBL2559514 0.81 TRIM24 (0.57) TRIM24TRIM33CDK8AXLUNG
SCHEMBL2561212 0.81 MAP4K4 (0.53) CDK8MAPTCASP1PIK3C3DYRK1B
SCHEMBL2563039 0.80 TRIM24 (0.52) TRIM24TRIM33CDK8AXLUNG
SCHEMBL14931902 0.79 PARP1 (0.51) PIK3C3DYRK1ADYRK2DYRK1BDYRK3
SCHEMBL2561506 0.77 ERN1 (0.48) MAPTCASP1NPC1RAB9ACYP2C9
SCHEMBL14931833 0.76 ACMSD (0.55) MAPTCASP1NPC1RAB9ANPSR1
SCHEMBL2558096 0.76 TRIM24 (0.57) TRIM24TRIM33NPC1RAB9ACYP2C9

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