SCHEMBL322275

SCHEMBL322275

COC(=O)c1c(O)c2c(OC)c(C)ccc2[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM5A P29375 1/20 0.38
KDM5B Q9UGL1 1/20 0.38
NR4A2 P43354 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PADI4 Q9UM07 1/20 0.37
GRIN2D O15399 1/20 0.37
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN2A Q12879 1/20 0.37

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
SCHEMBL7754982 0.88 KDM5A (0.52) MEN1KMT2AKDM4EALDH1A1KDM5A
SCHEMBL7826753 0.88 KDM4E (0.38) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL321280 0.84 USP2 (0.44) USP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL2482875 0.82 KDM4E (0.52) USP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL321856 0.82 KDM5A (0.44) USP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL4648517 0.78 USP2 (0.44) USP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL3981085 0.77 MEN1 (0.51) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL7556725 0.76 KMT2A (0.43) USP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL14335867 0.76 USP2 (0.44) USP2MEN1KMT2AKDM4EALDH1A1
SCHEMBL7828560 0.75 GPBAR1 (0.40) MEN1KMT2AKDM4EAR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590949-A1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES Active Biotech AB (SE) 2013-05-15 EP disclosed
WO-2012004338-A1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ACTIVE BIOTECH AB (SE) 2012-01-12 WO disclosed