SCHEMBL5822989

SCHEMBL5822989

O=C(c1cccc2ccccc12)N1CCN(Cc2c[nH]cn2)c2ccc(-c3cccc([AsH2])c3)cc2C1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 17/20 0.63
FNTB P49356 17/20 0.63
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL3499970 0.94 FNTA (0.71) FNTAFNTB
SCHEMBL3500284 0.91 FNTA (0.63) FNTAFNTB
SCHEMBL3503061 0.91 FNTA (0.63) FNTAFNTBALDH1A1LMNAMEN1
SCHEMBL3500586 0.90 FNTA (0.73) FNTAFNTBALDH1A1LMNA
SCHEMBL3499547 0.90 FNTA (0.64) FNTAFNTB
SCHEMBL3502056 0.89 FNTA (0.65) FNTAFNTBALDH1A1LMNA
SCHEMBL3500156 0.87 FNTA (0.61) FNTAFNTBALDH1A1LMNA
SCHEMBL3502480 0.87 FNTA (0.58) FNTAFNTBALDH1A1LMNA
SCHEMBL3501377 0.86 FNTA (0.57) FNTAFNTBALDH1A1LMNAMEN1
SCHEMBL3501815 0.86 FNTA (0.65) 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-2005089515-A9 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES BRIGHAM & WOMENS HOSPITAL (US) 2006-01-26 WO disclosed