SCHEMBL3265376

SCHEMBL3265376

CNC(=O)NC1(C(N)=O)CCCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.38
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
P2RX7 Q99572 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
OPRL1 P41146 1/20 0.30
MEN1 O00255 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
SCHEMBL2847319 0.78 KDM4E (0.41) KMT2AKDM4EMAPTALDH1A1L3MBTL1
SCHEMBL32690599 0.78 KDM4E (0.39) KMT2AKDM4EMAPTALDH1A1P2RX7
SCHEMBL13448658 0.78 KDM4E (0.65) KMT2AKDM4EMAPTALDH1A1P2RX7
SCHEMBL30388905 0.77 CYP2C19 (0.47) KMT2AKDM4EMAPTALDH1A1L3MBTL1
SCHEMBL13448704 0.77 ALDH1A1 (0.40) KMT2AKDM4EMAPTALDH1A1L3MBTL1
SCHEMBL18122821 0.76 KDM4E (0.63) KMT2AKDM4EMAPTALDH1A1L3MBTL1
SCHEMBL4928521 0.76 KDM4E (0.38) KMT2AKDM4EMAPTALDH1A1P2RX7
SCHEMBL9613266 0.74 KDM4E (0.41) KMT2AKDM4EALDH1A1P2RX7SMN1; SMN2
SCHEMBL1957150 0.74 KDM4E (0.36) KMT2AKDM4EMAPTALDH1A1L3MBTL1
SCHEMBL2838138 0.73 KDM4E (0.37) KMT2AKDM4EMAPTALDH1A1P2RX7

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-2010054024-A2 NOVEL COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-05-14 WO disclosed