SCHEMBL2555669

SCHEMBL2555669

Cc1ccccc1-c1[nH]c2cc(F)cc(F)c2c1C=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
AHR P35869 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PARP1 P09874 1/20 0.36
TNKS2 Q9H2K2 2/20 0.36
TNKS O95271 1/20 0.36
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ERN1 O75460 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL2559271 0.88 AHR (0.38) MAPTAHRMEN1KMT2ATNKS2
SCHEMBL15331754 0.84 PARP1 (0.36) MAPTAHRMEN1KMT2APARP1
SCHEMBL2563016 0.83 MEN1 (0.33) MAPTAHRMEN1KMT2A
SCHEMBL2559317 0.81 PIM1 (0.37) MAPTAHRMEN1KMT2APARP1
SCHEMBL29955474 0.80 GSK3B (0.37) MAPTTNKS2TNKSMAPK13MAPK12
SCHEMBL2561797 0.80 AHR (0.40) MAPTAHRMEN1KMT2ATNKS2
SCHEMBL2558139 0.80 KDM4E (0.33) MAPTAHRMEN1KMT2APARP1
SCHEMBL29955797 0.78 KDM4E (0.38) MAPTMEN1KMT2APARP1TNKS2
SCHEMBL29952739 0.78 CSNK1D (0.36) MAPTAHRMEN1KMT2APARP1
SCHEMBL15331458 0.78 TNKS (0.33) MAPTAHRMEN1KMT2ATNKS2

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