SCHEMBL6505938

SCHEMBL6505938

CN(C)C(=O)C1(NC(=O)OC(C)(C)C)CCNCC1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GHSR Q92847 1/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
GAA P10253 2/20 0.31
CTSL P07711 1/20 0.30
P2RX7 Q99572 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
SCHEMBL22766211 0.89 MEN1 (0.36) KMT2AGHSRMEN1MAPK1GAA
SCHEMBL2482164 0.84 P2RX7 (0.35) KMT2AGHSRMEN1MAPK1GAA
SCHEMBL391041 0.83 KMT2A (0.43) KMT2AKDM4EGHSRMEN1MAPK1
SCHEMBL387928 0.81 KMT2A (0.39) KMT2AKDM4EGHSRMEN1MAPK1
SCHEMBL3955815 0.81 KMT2A (0.54) KMT2AKDM4EGHSRMEN1MAPK1
Hydrochloric Acid SCHEMBL26121308 0.80 KMT2A (0.38) KMT2AKDM4EGHSRMEN1MAPK1
SCHEMBL23120791 0.77 KMT2A (0.38) KMT2AKDM4EGHSRMEN1MAPK1
SCHEMBL3197011 0.77 KMT2A (0.34) KMT2AKDM4EGHSRMEN1MAPK1
SCHEMBL2340622 0.77 KMT2A (0.38) KMT2AKDM4EGHSRMEN1MAPK1
SCHEMBL1649897 0.77 KMT2A (0.34) KMT2AKDM4EGHSRMEN1MAPK1

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
WO-2005047253-A1 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD. (KR) 2005-05-26 WO disclosed