SCHEMBL4727166

SCHEMBL4727166

CCOC(=O)c1c(O)c2ccc(N=Cc3ccccc3)cc2[nH]c1=O

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.54
KDM5B Q9UGL1 1/20 0.54
MAPT P10636 2/20 0.53
KDM4E B2RXH2 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
ALOX15 P16050 1/20 0.53
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CSF1R P07333 1/20 0.47

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
SCHEMBL4701132 0.81 KDM5A (0.59) KDM5AKDM5BMAPTKDM4EALDH1A1
SCHEMBL5309082 0.80 KDM5A (0.58) KDM5AKDM5BCSF1R
SCHEMBL1058188 0.79 KDM5A (0.68) KDM5AKDM5BKDM4ERAB9ASMN1; SMN2
SCHEMBL5330015 0.78 KDM5A (0.64) KDM5AKDM5BKDM4EALDH1A1
SCHEMBL4647482 0.78 KDM5A (0.64) KDM5AKDM5BKDM4E
SCHEMBL8142770 0.77 KDM5A (0.62) KDM5AKDM5B
SCHEMBL10334091 0.75 EGFR (0.68) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL10334092 0.75 EGFR (0.68) MAPTKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL5334737 0.73 KDM5A (0.58) KDM5AKDM5BMAPTKDM4EMEN1
SCHEMBL18584559 0.73 KDM5A (0.57) KDM5AKDM5BKDM4ENPC1RAB9A

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-2008011337-A1 HCV INHIBITORS ABBOTT LABORATORIES (US) 2008-01-24 WO disclosed