SCHEMBL2561415

SCHEMBL2561415

CCOc1cccc(C=O)c1OCC(=O)NC(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.47
MAPK1 P28482 1/20 0.47
GAA P10253 2/20 0.44
KDM4E B2RXH2 2/20 0.42
RAB9A P51151 2/20 0.42
L3MBTL1 Q9Y468 4/20 0.41
ATM Q13315 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 2/20 0.39
HTT P42858 1/20 0.39
SRC P12931 1/20 0.39
LMNA P02545 3/20 0.39
NPC1 O15118 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38

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
SCHEMBL2555444 0.89 SRC (0.52) SMN1; SMN2MAPK1KDM4ERAB9AALDH1A1
SCHEMBL2556276 0.86 ALDH1A1 (0.44) SMN1; SMN2MAPK1GAAKDM4ERAB9A
SCHEMBL2553617 0.85 ALDH1A1 (0.47) SMN1; SMN2GAAKDM4ERAB9AL3MBTL1
SCHEMBL15332645 0.83 ALDH1A1 (0.53) SMN1; SMN2MAPK1KDM4ERAB9AL3MBTL1
SCHEMBL15333167 0.82 ALDH1A1 (0.48) SMN1; SMN2KDM4EL3MBTL1PTGDR2ALDH1A1
SCHEMBL2557685 0.82 SMN1; SMN2 (0.45) SMN1; SMN2GAAKDM4EL3MBTL1PTGDR2
SCHEMBL20150682 0.82 ALDH1A1 (0.49) KDM4ERAB9AL3MBTL1PTGDR2ALDH1A1
SCHEMBL6369657 0.81 SMN1; SMN2 (0.60) SMN1; SMN2MAPK1KDM4ERAB9AL3MBTL1
SCHEMBL9248575 0.81 PTGDR2 (0.60) SMN1; SMN2MAPK1KDM4ERAB9AL3MBTL1
SCHEMBL29955873 0.81 SRC (0.49) SMN1; SMN2MAPK1GAAKDM4ERAB9A

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