SCHEMBL5011859

SCHEMBL5011859

O=C(O)c1scnc1-c1cscn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.47
PKM P14618 1/20 0.47
KDM4A O75164 2/20 0.45
KDM4B O94953 2/20 0.45
KDM5C P41229 2/20 0.45
KDM5B Q9UGL1 2/20 0.45
ECE1 P42892 1/20 0.43
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
HSD17B10 Q99714 1/20 0.34
METAP1 P53582 1/20 0.32
GPR35 Q9HC97 2/20 0.32
DAO P14920 2/20 0.32
KAT6A Q92794 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
CHEK2 O96017 1/20 0.31
IDO1 P14902 1/20 0.31

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
SCHEMBL5011865 0.80 KDM4E (0.61) KDM4EPKMGPR35DAONPC1
SCHEMBL3711699 0.76 MAPK8 (0.48) KDM4EPKMKDM4AKDM4BKDM5C
SCHEMBL20027794 0.72 KDM4E (0.50) KDM4EPKMKDM4AKDM4BKDM5C
SCHEMBL25779061 0.71 CDC7 (0.50) KDM4EPKMHSD17B10L3MBTL1
SCHEMBL2832225 0.71 KDM4E (0.54) KDM4EPKMKDM4AKDM4BKDM5C
SCHEMBL25779065 0.70 KDM4E (0.50) KDM4EPKMKDM4AKDM4BKDM5B
SCHEMBL269858 0.70 KDM4E (0.53) KDM4EPKML3MBTL1
SCHEMBL14711219 0.70 KDM4E (0.46) KDM4EPKMHDAC1HDAC6
SCHEMBL4594949 0.69
SCHEMBL23294529 0.68 KDM4A (0.42) KDM4EKDM4AKDM4BKDM5CKDM5B

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
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 ASTRAZENECA AB (SE) 2008-12-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080312255-A1 PIPERDINE COMPOUNDS AND USES THEREOF-911 NISCH, PIR, QDPR KDM4E 3497/4885PKM 979/4885KDM4A 3955/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.