SCHEMBL6974441

SCHEMBL6974441

CCCCCCC(O)c1nc(C(C)C)c(Sc2cc(F)cc(F)c2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.39
GCGR P47871 14/20 0.34
ADRB2 P07550 3/20 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
SCHEMBL6966542 0.87 GPR84 (0.39) GPR84GCGRADRB2
SCHEMBL7081628 0.86 GPR84 (0.39) GPR84GCGRADRB2
SCHEMBL6973131 0.84 TYMS (0.30)
SCHEMBL6965426 0.83 GPR84 (0.33) GPR84
SCHEMBL6974091 0.81 MAPK14 (0.33)
SCHEMBL6967229 0.81
SCHEMBL6970400 0.81 GCGR (0.31) GCGR
SCHEMBL6966507 0.80 CHRNB2 (0.30)
SCHEMBL6969061 0.75
SCHEMBL6968164 0.75

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