SCHEMBL1126915

SCHEMBL1126915

CC(C)(I)c1c[nH]c(C=O)c1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 1/20 0.30
ATP4B P51164 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
SCHEMBL7620438 0.83 ATP4A (0.31) ATP4AATP4B
SCHEMBL3415353 0.67
SCHEMBL1126808 0.67
SCHEMBL10278083 0.66
SCHEMBL10401726 0.63 APP (0.33) ATP4AATP4B
SCHEMBL2362181 0.63
SCHEMBL5917879 0.63
SCHEMBL2713687 0.63
SCHEMBL1162201 0.63
SCHEMBL4043164 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2283006-A1 PYRROLE ANTIFUNGAL AGENTS F2G Limited (GB) 2011-02-16 EP disclosed
WO-2009130481-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2009-10-29 WO disclosed