SCHEMBL2557773

SCHEMBL2557773

Cc1ccc2c(C=O)c(-c3cccc(F)c3F)[nH]c2c1C

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
DYRK1A Q13627 1/20 0.34
ERN1 O75460 1/20 0.32
SLC9A1 P19634 1/20 0.31
KDM4E B2RXH2 2/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KCNA3 P22001 1/20 0.31
MAPK13 O15264 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
MAPT P10636 2/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL15332197 0.90 TNKS (0.42) TNKSTNKS2ERN1KDM4ENPC1
SCHEMBL2554134 0.87 PDE7A (0.40) TNKSTNKS2DYRK1AKDM4EALDH1A1
SCHEMBL15331062 0.85 ERN1 (0.33) TNKSTNKS2ERN1KDM4ENPC1
SCHEMBL2561523 0.85 ERN1 (0.33) TNKSTNKS2DYRK1AERN1
SCHEMBL2556780 0.84 FEN1 (0.38)
SCHEMBL15330432 0.84 MAPT (0.36) TNKSTNKS2KDM4ENPC1ALDH1A1
SCHEMBL2559216 0.82 DYRK1A (0.36) TNKSTNKS2DYRK1ASLC9A1KDM4E
SCHEMBL2562003 0.81 ABCB1 (0.37) TNKSTNKS2DYRK1AERN1SLC9A1
SCHEMBL2550909 0.80 TNKS (0.37) TNKSTNKS2ALDH1A1MAPK13MAPK12
SCHEMBL15332902 0.80 DHODH (0.37) TNKSTNKS2DYRK1ASLC9A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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