SCHEMBL28301121

SCHEMBL28301121

CCCCCc1cc2cc(OC)c(OC)cc2oc1=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
KDM4E B2RXH2 3/20 0.52
USP2 O75604 2/20 0.52
HTT P42858 2/20 0.52
POLB P06746 2/20 0.52
APAF1 O14727 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
BLM P54132 1/20 0.52
ATM Q13315 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
CRHBP P24387 1/20 0.51
CRHR2 Q13324 1/20 0.51
CNR1 P21554 10/20 0.50
CNR2 P34972 10/20 0.50
NOD2 Q9HC29 1/20 0.50
GPR55 Q9Y2T6 7/20 0.48

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
SCHEMBL15396979 0.86 KDM4E (0.52) MEN1KMT2AKDM4EUSP2HTT
SCHEMBL6109649 0.79 KDM4E (0.59) MEN1KMT2AKDM4EUSP2HTT
SCHEMBL4282429 0.78 MCL1 (0.49) CNR1CNR2GPR55
SCHEMBL45450 0.76 MAOB (0.61) MEN1KMT2AKDM4EHTTPOLB
SCHEMBL11878333 0.75 SRC (0.58) MEN1KMT2AKDM4EUSP2HTT
SCHEMBL4527127 0.75 HSD17B3 (0.55) MEN1KMT2AKDM4EHTTPOLB
SCHEMBL11879786 0.75 KDM4E (0.47) MEN1KMT2AKDM4EUSP2HTT
SCHEMBL28535264 0.75 MAOB (0.59) MEN1KMT2AKDM4EUSP2HTT
SCHEMBL21385208 0.75 MAOB (0.59) MEN1KMT2AKDM4EUSP2HTT
SCHEMBL6136580 0.75 MAOB (0.59) MEN1KMT2AKDM4EUSP2HTT

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
CN-109890378-A FOXO1 activity-inhibiting composition 三得利控股株式会社 2019-06-14 CN disclosed