SCHEMBL2561677

SCHEMBL2561677

CCNC(=O)C(C)Oc1c(C=O)cccc1OCC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 2/20 0.40
HCRTR1 O43613 2/20 0.37
POLB P06746 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
LMNA P02545 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36
SRC P12931 1/20 0.36
ATM Q13315 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL15331030 0.89 KMT2A (0.40) SMN1; SMN2KMT2AL3MBTL1KDM4EPTGDR2
SCHEMBL29954241 0.89 SRC (0.48) SMN1; SMN2KDM4EPOLBLMNAALDH1A1
SCHEMBL15330607 0.85 KMT2A (0.43) SMN1; SMN2KMT2AL3MBTL1KDM4EPTGDR2
SCHEMBL2553823 0.84 KMT2A (0.42) SMN1; SMN2KMT2AL3MBTL1KDM4EPTGDR2
SCHEMBL29952275 0.82 SMN1; SMN2 (0.52) SMN1; SMN2KMT2APOLBPTGDR2LMNA
SCHEMBL2553617 0.81 ALDH1A1 (0.47) SMN1; SMN2KMT2AL3MBTL1KDM4EPOLB
SCHEMBL7360392 0.80 SRC (0.41) SMN1; SMN2KMT2AL3MBTL1KDM4EPTGDR2
SCHEMBL2562126 0.80 SRC (0.46) SMN1; SMN2KDM4EPOLBLMNANPC1
SCHEMBL20108986 0.79 ALDH1A1 (0.42) SMN1; SMN2KMT2AL3MBTL1KDM4EPTGDR2
SCHEMBL5562717 0.79 PTGDR2 (0.41) SMN1; SMN2KMT2AL3MBTL1KDM4EPTGDR2

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