SCHEMBL7539892

SCHEMBL7539892

CCn1nccc1OCc1ccc(Cl)c(-n2nnn(C)c2=O)c1SC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 17/20 0.36
KDM5A P29375 15/20 0.36
KDM5B Q9UGL1 15/20 0.36
KDM2B Q8NHM5 5/20 0.34
KDM4A O75164 4/20 0.34
KDM4E B2RXH2 1/20 0.34
KDM6B O15054 1/20 0.34
KDM4B O94953 1/20 0.34
KDM4D Q6B0I6 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
KDM3A Q9Y4C1 1/20 0.34

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
SCHEMBL7539897 0.84 GCK (0.33)
SCHEMBL6333530 0.72 MEN1 (0.32) KDM4CKDM5AKDM5B
SCHEMBL6333418 0.71
SCHEMBL6326674 0.69 MEN1 (0.30)
SCHEMBL7540906 0.65 KDM5A (0.31) KDM4CKDM5AKDM5BKDM2BKDM4A
SCHEMBL6408428 0.64
SCHEMBL6327267 0.64 SMN1; SMN2 (0.33) KDM4CKDM5AKDM5B
SCHEMBL6858814 0.62
SCHEMBL7548038 0.61 KDM4C (0.41) KDM4CKDM5AKDM5BKDM2BKDM4A
SCHEMBL6324111 0.61

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-1208090-A1 HERBICIDALTETRAZOLINONE DERIVATIVES NIHON BAYER AGROCHEM K.K. (JP) 2002-05-29 EP disclosed
WO-2001010850-A1 HERBICIDAL TETRAZOLINONE DERIVATIVES NIHON BAYER AGROCHEM K.K. (DE) 2001-02-15 WO disclosed