SCHEMBL2561466

SCHEMBL2561466

C=CCNC(=O)C(C)Oc1cccc(C=O)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MAPT P10636 1/20 0.42
OGG1 O15527 1/20 0.42
HPGD P15428 2/20 0.42
GAA P10253 1/20 0.41
POLB P06746 1/20 0.41
RECQL P46063 1/20 0.41
SRC P12931 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
ATM Q13315 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL2560029 0.85 ALDH1A3 (0.49) ALDH1A1HPGDGAAPOLBNPC1
SCHEMBL29950635 0.85 SMN1; SMN2 (0.48) ALDH1A1MAPTOGG1GAAPOLB
SCHEMBL2559130 0.84 ALDH1A1 (0.45) ALDH1A1MAPTOGG1GAAPOLB
SCHEMBL2553147 0.83 ALDH1A1 (0.48) ALDH1A1MAPTOGG1GAAPOLB
SCHEMBL2557847 0.82 ALDH1A1 (0.47) ALDH1A1MAPTOGG1HPGDGAA
SCHEMBL2556751 0.82 ALDH1A1 (0.45) ALDH1A1MAPTOGG1HPGDGAA
SCHEMBL2554358 0.81 HPGD (0.52) ALDH1A1MAPTOGG1HPGDGAA
SCHEMBL29953970 0.81 GAA (0.52) ALDH1A1MAPTOGG1GAAPOLB
SCHEMBL2552258 0.81 ALDH1A1 (0.48) ALDH1A1MAPTOGG1HPGDGAA
SCHEMBL2553612 0.80 ALDH1A1 (0.54) ALDH1A1MAPTOGG1GAAPOLB

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