SCHEMBL2555745

SCHEMBL2555745

CC(C(=O)NC(N)=O)N1CCCCC1C=O

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
SIGMAR1 Q99720 1/20 0.31
EPHX2 P34913 2/20 0.30
PARP1 P09874 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
CTSD P07339 1/20 0.30
OPRK1 P41145 1/20 0.30

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
SCHEMBL15329588 0.84 XIAP (0.33) KDM4ESIGMAR1
SCHEMBL15330465 0.84 SIGMAR1 (0.33) KDM4ESIGMAR1
SCHEMBL2557783 0.83 SCN3A (0.36) KDM4EPARP1
SCHEMBL2555706 0.82 TDP1 (0.35) KDM4ESIGMAR1EPHX2GAAHTT
SCHEMBL29956844 0.81 KDM4E (0.45) KDM4ESIGMAR1EPHX2HTT
SCHEMBL29955496 0.81 SIGMAR1 (0.36) KDM4ESIGMAR1GAA
SCHEMBL29956239 0.81 KDM4E (0.48) KDM4ESIGMAR1EPHX2HTT
SCHEMBL29952973 0.80 SIGMAR1 (0.33) KDM4ESIGMAR1
SCHEMBL2557932 0.80 EPHX1 (0.41) SIGMAR1HTTCTSD
SCHEMBL2559507 0.79 SIGMAR1 (0.40) KDM4ESIGMAR1

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