SCHEMBL8545560

SCHEMBL8545560

CC(C)C[C@H](Cl)C(=O)Oc1ccc(-c2ncc(OC(F)C(F)(F)OC(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cn2)cc1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.31

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
SCHEMBL8546599 0.97 CTRC (0.31) CTRC
SCHEMBL8546579 0.87
SCHEMBL8545556 0.86 AAK1 (0.33) CTRC
SCHEMBL8546595 0.84 AAK1 (0.31)
SCHEMBL8545574 0.80 PTPN5 (0.33)
SCHEMBL8540411 0.80
SCHEMBL8539471 0.79 HDAC4 (0.30)
SCHEMBL8544771 0.78 MEN1 (0.37)
SCHEMBL8541990 0.77 MAPT (0.33)
SCHEMBL8540084 0.77 PTPN5 (0.33)

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-0736078-B1 CHIRAL LIQUID CRYSTAL COMPOUNDS HAVING A PERFLUOROETHER TERMINAL PORTION MINNESOTA MINING & MFG (US) 1998-06-24 EP disclosed