SCHEMBL7438883

SCHEMBL7438883

CCCCCN(Cc1ccc(-c2ccccc2-c2noc(=O)[nH]2)cc1)c1c(N)ccn(CC(=O)N2CCCCC2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 1/20 0.48
AGTR1 P30556 8/20 0.46
PPARG P37231 5/20 0.44
KCNH2 Q12809 1/20 0.44
AGTR2 P50052 2/20 0.43
SLC33A1 O00400 3/20 0.41

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
SCHEMBL20778228 0.68 AGTR1 (0.85) AGTR1PPARGKCNH2
SCHEMBL20778212 0.67 AGTR1 (0.85) AGTR1PPARGKCNH2
SCHEMBL14245289 0.67 AGTR1 (0.56) AGTR1PPARGKCNH2SLC33A1
SCHEMBL14245122 0.66 AGTR1 (0.56) AGTR1PPARGKCNH2SLC33A1
SCHEMBL9183459 0.66 AGTR1 (0.36) AGTR1AGTR2
SCHEMBL1892679 0.65 AGTR1 (0.60) AGTR1PPARGSLC33A1
SCHEMBL20778197 0.65 AGTR1 (0.80) AGTR1PPARGKCNH2
SCHEMBL12348453 0.64 LTB4R2 (0.58) LTB4R2AGTR1SLC33A1
SCHEMBL8092937 0.62 AGTR1 (0.40) AGTR1AGTR2
SCHEMBL13277840 0.62 AGTR1 (0.62) AGTR1PPARGKCNH2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628556-A1 Imidazopyridines MERCK PATENT GmbH (DE) 1994-12-14 EP disclosed