SCHEMBL6974422

SCHEMBL6974422

CCn1c(CCCO)nc(C(C)C)c1Sc1cc(F)cc(F)c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GCGR P47871 5/20 0.31
ALDH1A1 P00352 2/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL6969009 0.93 ALDH1A1 (0.31) GCGRALDH1A1LMNAMAPT
SCHEMBL6975444 0.92
SCHEMBL6974517 0.91 MEN1 (0.36) GCGRALDH1A1MAPT
SCHEMBL7082887 0.90 GCGR (0.33) GCGRALDH1A1
SCHEMBL6961144 0.89 GCGR (0.39) GCGRALDH1A1
SCHEMBL6973789 0.88 GCGR (0.35) GCGR
SCHEMBL6961567 0.88 DHODH (0.35) GCGRALDH1A1LMNAMAPT
SCHEMBL6973018 0.88
SCHEMBL6974056 0.87 TSHR (0.31) ALDH1A1
SCHEMBL6969554 0.87

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