SCHEMBL8350558

SCHEMBL8350558

CCCCc1nc(C(=O)OC)c(C(=O)OC)n1Cc1ccc(I)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.48
AGTR2 P50052 3/20 0.48
TLR7 Q9NYK1 2/20 0.47
TLR8 Q9NR97 1/20 0.45

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
SCHEMBL29109902 0.88 AGTR1 (0.48) AGTR1AGTR2TLR7
SCHEMBL8346282 0.83 AGTR2 (0.51) AGTR1AGTR2
SCHEMBL9471931 0.81 PTGS2 (0.46) AGTR1AGTR2
SCHEMBL9879808 0.80 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL7308185 0.77 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL8564634 0.76 AGTR2 (0.57) AGTR1AGTR2
SCHEMBL870 0.75 PPARG (0.57)
SCHEMBL1256306 0.74 TLR7 (0.56) AGTR1AGTR2TLR7TLR8
SCHEMBL15331639 0.74 TLR7 (0.54) AGTR1AGTR2TLR7TLR8
SCHEMBL7306374 0.73 AGTR1 (0.49) AGTR1AGTR2

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
US-6005105-A Process for producing imidazole derivative PHARMACIA & UPJOHN COMPANY (US) 1999-12-21 US disclosed
EP-0705266-B1 PROCESS FOR PRODUCING IMIDAZOLE DERIVATIVE UPJOHN CO (US) 1997-02-26 EP disclosed
EP-0705266-A1 PROCESS FOR PRODUCING IMIDAZOLE DERIVATIVE UPJOHN CO (US) 1996-04-10 EP disclosed
WO-1995000517-A1 PROCESS FOR PRODUCING IMIDAZOLE DERIVATIVE THE UPJOHN COMPANY (US) 1995-01-05 WO disclosed