SCHEMBL2563652

SCHEMBL2563652

CC1CCC(NC(=O)CN2CCCC(C=O)C2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SIGMAR1 Q99720 6/20 0.46
CHRM5 P08912 3/20 0.46
CHRM1 P11229 2/20 0.46
CHRM3 P20309 2/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
USP2 O75604 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL29955492 0.93 KDM4E (0.52) KDM4EL3MBTL1SIGMAR1CHRM5CHRM1
SCHEMBL29954761 0.89 SIGMAR1 (0.57) KDM4EL3MBTL1SIGMAR1CHRM5CHRM1
SCHEMBL29955589 0.88 SIGMAR1 (0.59) KDM4EL3MBTL1SIGMAR1CHRM5CHRM1
SCHEMBL29953482 0.88 SIGMAR1 (0.59) KDM4EL3MBTL1SIGMAR1CHRM5CHRM1
SCHEMBL2557931 0.84 SIGMAR1 (0.46) KDM4EL3MBTL1SIGMAR1CHRM5CHRM1
SCHEMBL15332158 0.83 KMT2A (0.47) KDM4EL3MBTL1SIGMAR1CHRM5CHRM3
SCHEMBL2557592 0.83 L3MBTL1 (0.61) KDM4EL3MBTL1SIGMAR1CHRM5CHRM1
SCHEMBL20578684 0.82 KDM4E (0.56) KDM4ERAB9AKMT2AALDH1A1SMN1; SMN2
SCHEMBL14174994 0.81 SIGMAR1 (0.59) KDM4EL3MBTL1SIGMAR1CHRM5CHRM3
SCHEMBL2556252 0.81 LMNA (0.47) KDM4EL3MBTL1SIGMAR1CHRM5CHRM1

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 6 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
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