SCHEMBL2558685

SCHEMBL2558685

[C-]#[N+]C(C(N)=O)N1CCN(c2cnccn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A7 Q99884 1/20 0.45
SORD Q00796 1/20 0.44
KDM4E B2RXH2 2/20 0.43
MAPT P10636 1/20 0.43
ACHE P22303 1/20 0.43
HRH3 Q9Y5N1 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PARP1 P09874 1/20 0.40
AOC3 Q16853 1/20 0.40

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
SCHEMBL2556236 0.83 ALDH1A1 (0.52) SLC6A7KDM4ELMNAL3MBTL1
SCHEMBL4723624 0.80 KDM4E (0.49) SLC6A7SORDKDM4EMAPTACHE
SCHEMBL11112988 0.71 KDM4E (0.48) SLC6A7SORDKDM4EHRH3RXFP1
SCHEMBL27723124 0.70 SLC6A7 (0.59) SLC6A7SORDKDM4EHRH3RXFP1
SCHEMBL1743172 0.70 LMNA (0.50) SLC6A7SORDKDM4EMAPTACHE
SCHEMBL3710705 0.69 SLC6A7 (0.62) SLC6A7SORDKDM4EHRH3RXFP1
SCHEMBL18395354 0.69 KDM4E (0.68) KDM4EMAPTRXFP1LMNAL3MBTL1
SCHEMBL15887427 0.68 SORD (0.51) SLC6A7SORDKDM4EHRH3LMNA
SCHEMBL13073553 0.68 SLC6A7 (0.57) SLC6A7SORDKDM4EHRH3RXFP1
SCHEMBL11112987 0.68 SLC6A7 (0.50) SLC6A7SORDKDM4ELMNAL3MBTL1

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