SCHEMBL16631495

SCHEMBL16631495

CCc1cc2cc(C)c[nH]c-2nc1=O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.34
HMBS P08397 1/20 0.33
KDM4E B2RXH2 2/20 0.31
TP53 P04637 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 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
SCHEMBL16631527 0.82 KMT2A (0.33) DAOHMBSMAPTKMT2A
SCHEMBL18081761 0.81 DAO (0.37) DAOHMBSKDM4E
SCHEMBL18080449 0.75 DAO (0.33) DAOHMBSKDM4E
SCHEMBL16631462 0.73 SMN1; SMN2 (0.36) DAOKDM4ETP53ALDH1A1GAA
SCHEMBL16631496 0.72
SCHEMBL16631471 0.70 MAPK1 (0.37) KDM4ETP53ALDH1A1GAAMAPT
SCHEMBL18081934 0.67 HMBS (0.37) HMBS
SCHEMBL15782179 0.66 DAO (0.54) DAOHMBSKDM4ETP53MEN1
SCHEMBL16631364 0.64 MGAM (0.35) TP53ALDH1A1GAA
SCHEMBL16631936 0.62 HIF1A (0.33) KDM4EALDH1A1MAPTHPGDRAB9A

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-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed