SCHEMBL2650407

SCHEMBL2650407

CS(=O)(=O)c1ccc(I)s1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LOX P28300 6/20 0.44
L3MBTL1 Q9Y468 1/20 0.38
LOXL2 Q9Y4K0 2/20 0.34
LMNA P02545 1/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
ENPP2 Q13822 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
SCHEMBL19436416 0.82 LOX (0.57) LOXL3MBTL1LOXL2LMNAPPARG
SCHEMBL3149551 0.77 PSIP1 (0.37) LOXL3MBTL1LOXL2
SCHEMBL2997802 0.76 L3MBTL1 (0.33) L3MBTL1
SCHEMBL2606680 0.73 KMT2A (0.52) LOXL3MBTL1LOXL2LMNANPSR1
SCHEMBL15880558 0.71 LOX (0.48) LOXL3MBTL1LOXL2LMNAPPARG
SCHEMBL1164361 0.71 HTT (0.50) LOXLMNANPSR1
SCHEMBL3464178 0.71 LOX (0.44) LOXL3MBTL1LOXL2LMNAPPARG
SCHEMBL13874742 0.71 LOX (0.48) LOXL3MBTL1LOXL2NPSR1
SCHEMBL10050617 0.71 L3MBTL1 (0.47) LOXL3MBTL1
SCHEMBL3202558 0.70 LOX (0.43) LOXL3MBTL1LOXL2

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
WO-2004063194-A1 HETEROARYL COMPOUNDS ELI LILLY AND COMPANY (US) 2004-07-29 WO disclosed
EP-0759924-A1 OLIGOTHIOPHENES BASF AKTIENGESELLSCHAFT (DE) 1997-03-05 EP disclosed
WO-1995030679-A1 OLIGOTHIOPHENES BASF AKTIENGESELLSCHAFT (DE) 1995-11-16 WO disclosed