SCHEMBL6970027

SCHEMBL6970027

Cc1cc(C)cc(Sc2c(C(C)C)nc(/C=N/O)n2C)c1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL6970030 1.00 KDM4E (0.37) KDM4EALDH1A1
SCHEMBL6966166 0.86 KDM4E (0.36) KDM4E
SCHEMBL7086394 0.86 KDM4E (0.36) KDM4E
SCHEMBL7086393 0.86 KDM4E (0.36) KDM4E
SCHEMBL6966170 0.86 KDM4E (0.36) KDM4E
SCHEMBL7078796 0.83 KDM4E (0.47) KDM4EALDH1A1
SCHEMBL7078798 0.83 KDM4E (0.47) KDM4EALDH1A1
SCHEMBL6974766 0.83 MAPT (0.34)
SCHEMBL6961065 0.80 KDM4E (0.39) KDM4EALDH1A1
SCHEMBL6961068 0.80 KDM4E (0.39) KDM4EALDH1A1

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 4 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
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed