SCHEMBL8311775

SCHEMBL8311775

CC(C)(C)OC(=O)ON1CCc2ccc(NS(=O)(=O)c3ccc(OC4CCN(C(=O)OC(C)(C)C)CC4)cc3)cc2C1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.51
TGFBR1 P36897 8/20 0.45
STS P08842 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
LIMK2 P53671 1/20 0.42
ALOX12 P18054 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
KCNA1 Q09470 1/20 0.41
KCNAB1 Q14722 1/20 0.41

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
SCHEMBL8311642 0.79 GPR119 (0.46) GPR119STSHRH3
SCHEMBL9959434 0.76 NLRP3 (0.51) KCNA1KCNAB1
SCHEMBL6365439 0.75 KCNA1 (0.60) TGFBR1STSNPC1RAB9AKCNA1
SCHEMBL5778881 0.74 KCNA1 (0.57) TGFBR1NPC1RAB9ALIMK2KCNA1
SCHEMBL5440052 0.74 KCNA1 (0.56) TGFBR1STSNPC1RAB9ALIMK2
Hydrochloric Acid SCHEMBL8312274 0.74 F10 (0.61)
SCHEMBL8311347 0.73 F10 (0.64)
SCHEMBL5434427 0.73 KCNA1 (0.55) TGFBR1NPC1RAB9ALIMK2KCNA1
SCHEMBL9958499 0.72 NAMPT (0.47) TGFBR1KCNA1KCNAB1
SCHEMBL8590787 0.72 F10 (0.69)

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-0937723-A1 Novel sulfonamides, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1999-08-25 EP disclosed