SCHEMBL2559520

SCHEMBL2559520

CC(C)CN(CC(N)=O)c1cccc(Cl)c1C=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 6/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
GLA P06280 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
NR1H4 Q96RI1 4/20 0.35
TSHR P16473 1/20 0.35
BLM P54132 1/20 0.35
HIF1A Q16665 1/20 0.35
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34

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
SCHEMBL29951041 0.88 KMT2A (0.48) MEN1ALDH1A1KMT2ATDP1LMNA
SCHEMBL29952257 0.82 KMT2A (0.42) RORCMEN1ALDH1A1KMT2ATDP1
SCHEMBL29957441 0.81 ALDH1A1 (0.39) MEN1ALDH1A1KMT2ATDP1LMNA
SCHEMBL29955447 0.80 KMT2A (0.46) MEN1ALDH1A1KMT2ATDP1LMNA
SCHEMBL2559629 0.79 AOC3 (0.36) RORCMEN1ALDH1A1KMT2ATDP1
SCHEMBL2555361 0.74 ALDH1A3 (0.38) MEN1ALDH1A1KMT2ANPSR1MAPT
SCHEMBL29951982 0.73 ALDH1A1 (0.43) MEN1ALDH1A1KMT2ATDP1LMNA
SCHEMBL2560938 0.72 ALDH1A1 (0.50) MEN1ALDH1A1KMT2ATDP1NPSR1
SCHEMBL29951670 0.72 MEN1 (0.40) MEN1ALDH1A1KMT2ATDP1LMNA
SCHEMBL29954704 0.71 KMT2A (0.42) MEN1ALDH1A1KMT2ATDP1LMNA

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