SCHEMBL6208923

SCHEMBL6208923

CSc1sc(N=CNC(=O)OC(C)(C)C)cc1S(=O)(=O)c1cccc(-c2cccc(C=O)c2)c1C

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
C1S P09871 17/20 0.42
NAT1 P18440 1/20 0.30

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
SCHEMBL6208918 1.00 C1S (0.42) C1SNAT1
SCHEMBL6210980 0.88 C1S (0.33) C1S
SCHEMBL6210638 0.87 SLC9A1 (0.34) C1S
SCHEMBL6210643 0.87 SLC9A1 (0.34) C1S
SCHEMBL6209499 0.85 C1S (0.34) C1S
SCHEMBL5841042 0.85 C1S (0.45) C1S
SCHEMBL5841048 0.85 C1S (0.45) C1S
SCHEMBL5840265 0.85 C1S (0.49) C1S
SCHEMBL5840261 0.85 C1S (0.49) C1S
SCHEMBL5839748 0.84 C1S (0.47) C1S

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549632-A4 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS DIMENSIONAL PHARM INC (US) 2005-11-09 EP disclosed
EP-1549632-A1 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2005-07-06 EP disclosed
WO-2003099805-A1 NOVEL THIOPHENE AMIDINES, COMPOSITIONS THEREOF, AND METHODS OF TREATING COMPLEMENT-MEDIATED DISEASES AND CONDITIONS 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 2003-12-04 WO disclosed