SCHEMBL14865409

SCHEMBL14865409

CCCCc1c(CC)cc(C(=O)Nc2nc(CC(=O)OC)cs2)c(=O)n1CCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 1/20 0.46
RAB9A P51151 2/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 4/20 0.43
TSHR P16473 2/20 0.43
ALDH1A1 P00352 4/20 0.42
PKM P14618 1/20 0.42
LMNA P02545 1/20 0.42
TRPV4 Q9HBA0 1/20 0.41
MAPT P10636 2/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL5518874 0.87 CNR2 (0.50) HTTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL14865391 0.76 CNR2 (0.39) HTTSMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL5522923 0.73 CNR2 (0.43) HTTMEN1KMT2AKDM4ENPC1
SCHEMBL5515502 0.71 CNR2 (0.61)
SCHEMBL5520743 0.69 CNR2 (0.53)
SCHEMBL11922863 0.69 CNR2 (0.55)
SCHEMBL2746072 0.69 CNR2 (0.46)
SCHEMBL5521564 0.69 CNR2 (0.46)
SCHEMBL5523383 0.68 CNR2 (0.49) MAPTHSD17B10
SCHEMBL2745229 0.68 CNR2 (0.49) MAPTHSD17B10

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-1806342-B1 3-CARBAMOYL-2-PYRIDONE DERIVATIVE SHIONOGI & CO (JP) 2013-04-17 EP disclosed