SCHEMBL6317316

SCHEMBL6317316

CS(=O)(=O)N([C@@H](Cc1ccccc1)C(=O)N1CCN(Cc2c[nH]cn2)c2ccc(-c3ccccc3)cc2C1)S(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FNTA P49354 12/20 0.41
FNTB P49356 12/20 0.41
CACNA1G O43497 1/20 0.33
CACNA1H O95180 1/20 0.33
CACNA1I Q9P0X4 1/20 0.33
HSD17B10 Q99714 1/20 0.32
CTSB P07858 1/20 0.32
CHRM1 P11229 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32

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
SCHEMBL6317325 1.00 FNTA (0.41) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3502550 0.91 FNTA (0.42) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3502548 0.91 FNTA (0.42) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3501455 0.81 FNTA (0.45) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3498391 0.81 FNTA (0.48) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3503031 0.81 FNTA (0.47) FNTAFNTBHSD17B10CHRM1ALDH1A1
SCHEMBL3501004 0.81 FNTA (0.49) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3500345 0.81 FNTA (0.50) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3499400 0.81 CACNA1G (0.43) FNTAFNTBCACNA1GCACNA1HCACNA1I
SCHEMBL3499396 0.81 CACNA1G (0.43) FNTAFNTBCACNA1GCACNA1HCACNA1I

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-A2 METHODS FOR THE TREATMENT OF SYNUCLEINOPATHIES THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2005-09-29 WO claimed