SCHEMBL2554079

SCHEMBL2554079

CCC(C)(C)NC(=O)C(C)N1CCCCC1C=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
FKBP1A P62942 3/20 0.34
HTT P42858 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
DPP4 P27487 1/20 0.32

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
SCHEMBL29952973 0.88 SIGMAR1 (0.33) FKBP1AKDM4EALDH1A1SIGMAR1
SCHEMBL29955496 0.81 SIGMAR1 (0.36) KDM4EALDH1A1SIGMAR1
SCHEMBL15329588 0.80 XIAP (0.33) KDM4EALDH1A1SIGMAR1
SCHEMBL15330465 0.80 SIGMAR1 (0.33) KDM4ESIGMAR1
SCHEMBL15333259 0.78 SIGMAR1 (0.33) HTTKDM4ESIGMAR1DPP4
SCHEMBL2559507 0.78 SIGMAR1 (0.40) KDM4EALDH1A1TSHRSIGMAR1
SCHEMBL29952848 0.78 EPHX1 (0.42) POLBHTTKDM4EALDH1A1
SCHEMBL29956239 0.78 KDM4E (0.48) HTTKDM4EALDH1A1TSHRSIGMAR1
SCHEMBL29956844 0.78 KDM4E (0.45) HTTKDM4EALDH1A1TSHRSIGMAR1
SCHEMBL2555745 0.77 KDM4E (0.31) HTTKDM4ESIGMAR1

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