SCHEMBL6972384

SCHEMBL6972384

Cc1cc(C)cc(S(=O)(=O)c2c(C(C)C)nc(CO)n2C)c1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
LOXL2 Q9Y4K0 2/20 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
SCHEMBL6973358 0.86 HTR6 (0.31) LOXL2
SCHEMBL6973964 0.82 MAPT (0.35) MAPTHTTKMT2A
SCHEMBL6962332 0.73 LOXL2 (0.39) LOXL2
SCHEMBL6965342 0.70 NOTUM (0.31) SMN1; SMN2
SCHEMBL6966612 0.69
SCHEMBL6957837 0.62
SCHEMBL6969457 0.61
SCHEMBL8137089 0.61 GAA (0.52) MAPTHTTKMT2A
SCHEMBL6976916 0.60 DHODH (0.35)
SCHEMBL6970602 0.60 DHODH (0.31)

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