SCHEMBL2561417

SCHEMBL2561417

CCOc1ccccc1Nc1ncc(C=O)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.49
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
HTT P42858 2/20 0.47
GAA P10253 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 2/20 0.46
EGFR P00533 1/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 2/20 0.44
MCL1 Q07820 1/20 0.44
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
IGF1R P08069 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL15330429 0.87 RAB9A (0.53) MAPK10KMT2AMEN1GAASMN1; SMN2
SCHEMBL4227898 0.83 MAPK10 (0.53) MAPK10KMT2AMEN1HTTGAA
SCHEMBL11521594 0.77 MAPK10 (0.62) MAPK10KMT2AMEN1HTTGAA
SCHEMBL2559656 0.75 HDAC3 (0.57) KMT2AHTTSMN1; SMN2ALDH1A1MAPK1
SCHEMBL15332185 0.73 SYK (0.56) KMT2AMEN1HTTSMN1; SMN2LMNA
SCHEMBL29951333 0.73 ULK1 (0.51) GAASMN1; SMN2ALDH1A1ALOX15MAPK1
SCHEMBL7525333 0.73 ALDH1A1 (0.57) MAPK10KMT2AMEN1GAASMN1; SMN2
SCHEMBL29058619 0.71 MAPK10 (0.52) MAPK10KMT2AMEN1HTTGAA
SCHEMBL8970984 0.71 MAPK10 (0.55) MAPK10KMT2AMEN1HTTGAA
SCHEMBL23094602 0.71 HDAC6 (0.53) KMT2AMEN1GAAALDH1A1EGFR

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