SCHEMBL21090352

SCHEMBL21090352

CCC(=O)C(C)(C)NCCOCCOCC(=O)C(C)(C)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.32
CES2 O00748 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
SCHEMBL21089817 0.89 MEN1 (0.33) MEN1KMT2AKDM4ECES2
SCHEMBL21937551 0.87 MEN1 (0.34) MEN1KMT2A
SCHEMBL24211117 0.85 KDM4E (0.39) MEN1KMT2AKDM4ECES2
SCHEMBL24894989 0.84 MEN1 (0.36) MEN1KMT2AKDM4ECES2
SCHEMBL21089631 0.84 MEN1 (0.38) MEN1KMT2AKDM4E
SCHEMBL24401387 0.82 MEN1 (0.37) MEN1KMT2AKDM4E
SCHEMBL21090435 0.80 KDM4E (0.32) KDM4ECES2
SCHEMBL21089634 0.79 MEN1 (0.34) MEN1KMT2A
SCHEMBL21089825 0.78 MEN1 (0.33) MEN1KMT2A
SCHEMBL22428348 0.77 MGLL (0.38)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3226906-B1 GLP-1 DERIVATIVES AND USES THEREOF NOVO NORDISK AS (DK) 2019-06-12 EP disclosed