SCHEMBL2558052

SCHEMBL2558052

N#Cc1ccccc1N1CCC(C(=O)O)C1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 15/20 0.68
CHRM4 P08173 1/20 0.49
KDM4E B2RXH2 1/20 0.47
RECQL P46063 1/20 0.47
GRM1 Q13255 1/20 0.46
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46

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
SCHEMBL29952767 0.92 NOTUM (0.57) NOTUMKDM4EGRM1DRD2DRD4
SCHEMBL29950827 0.92 NOTUM (0.57) NOTUMKDM4EGRM1DRD2DRD4
SCHEMBL15330773 0.92 NOTUM (0.57) NOTUMKDM4EGRM1DRD2DRD4
SCHEMBL2558711 0.91 NOTUM (0.55) NOTUMCHRM4KDM4ERECQLDRD2
SCHEMBL2557537 0.82 NOTUM (0.70) NOTUM
SCHEMBL15331259 0.82 NOTUM (0.55) NOTUM
SCHEMBL2557367 0.81 GAA (0.70) NOTUMKDM4E
SCHEMBL30332131 0.81 GAA (0.67) CHRM4KDM4ERECQLDRD2DRD4
SCHEMBL2558517 0.79 NOTUM (0.49) NOTUM
SCHEMBL1704630 0.79 NOTUM (0.72) NOTUM

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