SCHEMBL2560950

SCHEMBL2560950

COc1ccc(OC(C)C(=O)NC(C)C)c(C=O)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
RAB9A P51151 1/20 0.52
ERN1 O75460 4/20 0.47
ALDH1A1 P00352 2/20 0.44
TRIM24 O15164 1/20 0.43
TYR P14679 1/20 0.43
TRIM33 Q9UPN9 1/20 0.43
JUN P05412 1/20 0.43
NFKB1 P19838 1/20 0.43
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
TSHR P16473 1/20 0.40
MAPT P10636 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
HPGDS O60760 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
SCHEMBL2559187 0.90 ALDH1A1 (0.55) KDM4ERAB9AERN1ALDH1A1TRIM24
SCHEMBL15331368 0.88 KDM4E (0.50) KDM4ERAB9AERN1ALDH1A1TRIM24
SCHEMBL29953839 0.85 SMN1; SMN2 (0.53) KDM4ERAB9AERN1ALDH1A1TRIM24
SCHEMBL2557934 0.85 KDM4E (0.47) KDM4ERAB9AERN1ALDH1A1TRIM24
SCHEMBL5561673 0.83 ERN1 (0.51) KDM4ERAB9AERN1ALDH1A1TRIM24
SCHEMBL2553829 0.83 SMN1; SMN2 (0.50) KDM4EALDH1A1HTTMEN1KMT2A
SCHEMBL29953044 0.83 SMYD3 (0.47) KDM4ERAB9AERN1ALDH1A1HTT
SCHEMBL2559877 0.83 KDM4E (0.51) KDM4ERAB9AERN1ALDH1A1TRIM24
SCHEMBL15329977 0.82 ERN1 (0.50) KDM4ERAB9AERN1ALDH1A1TRIM24
SCHEMBL2557556 0.82 RAB9A (0.47) KDM4ERAB9AERN1ALDH1A1TRIM24

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