SCHEMBL6973444

SCHEMBL6973444

Cc1cc(C)cc(Sc2c(C(C)C)nc(CCOC(N)=O)n2CC2CC2)c1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.30
ALDH1A1 P00352 1/20 0.30
PLA2G1B P04054 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ATG4B Q9Y4P1 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
SCHEMBL6974245 0.94
SCHEMBL8491626 0.91 RORC (0.33)
SCHEMBL6969001 0.90 CNR2 (0.31) CNR2ALDH1A1PLA2G1BNPSR1ATG4B
SCHEMBL6964487 0.90
SCHEMBL6973772 0.90
SCHEMBL6969118 0.87
SCHEMBL6974303 0.86
SCHEMBL6973092 0.85
SCHEMBL6973113 0.85 SMN1; SMN2 (0.34) ALDH1A1
SCHEMBL6966704 0.84

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 3 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
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed