SCHEMBL10070409

SCHEMBL10070409

CCCCOc1c(C(=O)NCc2ccc(F)cc2)nc2c(N3CCN(C)CC3=O)cc(N3CCOCC3C)cn2c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.37
TP53 P04637 1/20 0.36
GABRA1 P14867 2/20 0.34
DRD4 P21917 1/20 0.34
MAPT P10636 2/20 0.34
MTOR P42345 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
RECQL P46063 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
FAAH O00519 1/20 0.33
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PIK3C3 Q8NEB9 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL15101630 0.90 ENPP2 (0.36) CNR2TP53MTORPIK3C3
SCHEMBL10070415 0.90 CNR2 (0.40) CNR2TP53MAPTKDM4EALDH1A1
SCHEMBL368957 0.82 TP53 (0.38) CNR2TP53MTORLMNAPIK3C3
SCHEMBL369910 0.81 TP53 (0.39) CNR2TP53MAPTKDM4EALDH1A1
SCHEMBL10070934 0.80 THRB (0.40) CNR2TP53MAPTLMNAGAA
SCHEMBL10070939 0.80 LMNA (0.41) CNR2TP53MAPTLMNAGAA
SCHEMBL15101330 0.80 ENPP2 (0.38) CNR2TP53MAPTKDM4EALDH1A1
SCHEMBL10070403 0.79 SMN1; SMN2 (0.39) CNR2TP53MAPTLMNANPSR1
SCHEMBL367904 0.79 KCNH2 (0.37) CNR2GABRA1DRD4MTORKDM4E
SCHEMBL15097386 0.79 LRRK2 (0.42) GABRA1DRD4MTORALDH1A1HPGD

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-2012006680-A1 7, 9-NITROGEN RADICAL-4-OXO-4H-PYRIDO[L,2-A]PYRIMIDINE-2-CARBOXYLIC ACID BENZYLAMIDE ANTI-VIRALS AVEXA LIMITED (AU) 2012-01-19 WO disclosed