SCHEMBL16792176

SCHEMBL16792176

O=C(c1ccccc1OC(F)(F)F)N1CCN(Cc2cnc[nH]2)c2ccc(-c3ccncc3)cc2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FNTA P49354 20/20 1.00
FNTB P49356 20/20 1.00

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
SCHEMBL3501650 0.85 FNTA (0.75) FNTAFNTB
SCHEMBL3502476 0.80 FNTA (0.66) FNTAFNTB
SCHEMBL3500586 0.69 FNTA (0.73) FNTAFNTB
SCHEMBL3501256 0.69 FNTA (0.52) FNTAFNTB
SCHEMBL3501941 0.69 FNTA (0.54) FNTAFNTB
SCHEMBL3501681 0.68 FNTA (0.52) FNTAFNTB
SCHEMBL3498524 0.68 FNTA (0.52) FNTAFNTB
SCHEMBL3500164 0.68 FNTA (0.73) FNTAFNTB
SCHEMBL3502156 0.66 FNTA (0.49) FNTAFNTB
SCHEMBL3499485 0.66 FNTA (0.51) FNTAFNTB

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
WO-2015089349-A1 INHIBITION OF ISOPRENOID BIOSYNTHETIC PATHWAYS TO TREAT NEUROINFLAMMATORY DISORDERS TABACZYNSKI DAVID A (US) 2015-06-18 WO disclosed