SCHEMBL19993390

SCHEMBL19993390

Fc1ccc(-c2ccc(Cc3ccc(-c4ccc(F)c(I)c4I)c(I)c3)cc2I)c(I)c1I

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32

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
SCHEMBL19993402 0.77 CYP17A1 (0.41) CYP17A1CYP11B1CYP11B2
SCHEMBL19993339 0.74 SNCA (0.35)
SCHEMBL22621190 0.74 GPR3 (0.33)
SCHEMBL19993395 0.72
SCHEMBL19993271 0.72 PTGS1 (0.38) CYP17A1CYP11B1CYP11B2
SCHEMBL19993285 0.72 TTR (0.33)
SCHEMBL19993393 0.72 TTR (0.30)
SCHEMBL19993368 0.68 CA2 (0.31)
SCHEMBL3299911 0.65 CYP17A1 (0.52) CYP17A1CYP11B1CYP11B2
SCHEMBL19993269 0.64 CYP17A1 (0.41) CYP17A1CYP11B1CYP11B2

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-3512920-B1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DEVICE MERCK PATENT GMBH (DE) 2020-11-04 EP disclosed
WO-2018050573-A1 LIQUID CRYSTAL MEDIUM AND LIQUID CRYSTAL DEVICE MERCK PATENT GMBH (DE) 2018-03-22 WO disclosed