SCHEMBL7086393

SCHEMBL7086393

CC(C)c1nc(/C=N/O)n(C)c1Sc1cc(Cl)cc(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
HTR7 P34969 1/20 0.32
HTR6 P50406 1/20 0.32

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
SCHEMBL7086394 1.00 KDM4E (0.36) KDM4EDRD2HTR2AHTR7HTR6
SCHEMBL6961068 0.88 KDM4E (0.39) KDM4E
SCHEMBL6961065 0.88 KDM4E (0.39) KDM4E
SCHEMBL6970030 0.86 KDM4E (0.37) KDM4E
SCHEMBL6970027 0.86 KDM4E (0.37) KDM4E
SCHEMBL6966170 0.85 KDM4E (0.36) KDM4E
SCHEMBL6966166 0.85 KDM4E (0.36) KDM4E
SCHEMBL7081745 0.84 HSP90B1 (0.33)
SCHEMBL7081746 0.84 HSP90B1 (0.33)
SCHEMBL6162368 0.84 DRD2 (0.32) DRD2HTR2AHTR7HTR6

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-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed