SCHEMBL20573261

SCHEMBL20573261

NC(=O)Oc1ccc(F)cc1-c1ccc(F)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL9 O00512 12/20 0.44
CTNNB1 P35222 12/20 0.44
IDO1 P14902 1/20 0.38
SLC9A1 P19634 2/20 0.38
SCN9A Q15858 1/20 0.38
AR P10275 1/20 0.38
LRRK2 Q5S007 1/20 0.38
CHRM3 P20309 1/20 0.37

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
SCHEMBL20573268 0.87 BCL9 (0.40) BCL9CTNNB1SLC9A1SCN9ALRRK2
SCHEMBL20573272 0.87 BCL9 (0.44) BCL9CTNNB1SLC9A1SCN9AAR
SCHEMBL20573247 0.85 SCN9A (0.47) SCN9ACHRM3
SCHEMBL20573165 0.84 ERN1 (0.49) SLC9A1LRRK2
SCHEMBL17797025 0.83 PARP1 (0.42) SLC9A1SCN9A
SCHEMBL17797023 0.83 ERN1 (0.40) SLC9A1LRRK2CHRM3
SCHEMBL20573251 0.82 CHRM3 (0.42) SCN9ACHRM3
SCHEMBL20573325 0.82 APP (0.42) SLC9A1SCN9ACHRM3
SCHEMBL17796980 0.81 PTGDR2 (0.43)
SCHEMBL20573324 0.81 PDE4D (0.45) SLC9A1SCN9ACHRM3

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-3029026-B1 NOVEL BIPHENYL DERIVATIVE AND METHOD FOR PREPARING SAME DONG A ST CO LTD (KR) 2018-12-05 EP claimed