SCHEMBL3518853

SCHEMBL3518853

CCN(C(=O)c1cccc(Oc2cc(CC(N)c3cncn3C)ccc2C#N)c1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FNTA P49354 15/20 0.46
FNTB P49356 15/20 0.46
PGGT1B P53609 14/20 0.46
HTT P42858 1/20 0.38

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
SCHEMBL3516212 0.92 FNTA (0.47) FNTAFNTBPGGT1BHTT
SCHEMBL3518848 0.85 FNTA (0.45) FNTAFNTBPGGT1BHTT
SCHEMBL3516211 0.81 FNTA (0.45) FNTAFNTBPGGT1BHTT
SCHEMBL8125159 0.80 PGGT1B (0.55) FNTAFNTBPGGT1B
SCHEMBL3500640 0.80 FNTA (0.58) FNTAFNTBPGGT1B
SCHEMBL8125825 0.80 FNTA (0.61) FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL3515218 0.79 PGGT1B (0.54) FNTAFNTBPGGT1B
SCHEMBL3504226 0.79 FNTA (0.57) FNTAFNTBPGGT1B
SCHEMBL3498702 0.79 FNTA (0.75) FNTAFNTBPGGT1B
SCHEMBL5552068 0.78 FNTA (0.47) FNTAFNTBPGGT1B

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1744751-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-01-24 EP claimed
WO-2005089502-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2005-09-29 WO claimed
EP-2155197-A2 TREATMENT OF LYSOSOMAL STORAGE DISEASES Link Medicine Corporation (US) 2010-02-24 EP disclosed
WO-2008112525-A2 TREATMENT OF LYSOSOMAL STORAGE DISEASES LINK MEDICINE CORPORATION (US) 2008-09-18 WO disclosed
EP-1744751-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-01-24 EP disclosed
WO-2005089502-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2005-09-29 WO disclosed