SCHEMBL6205747

SCHEMBL6205747

Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)/C=C(\O)C(=O)O)c2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
PKM P14618 1/20 0.50
LMNA P02545 1/20 0.48
POLB P06746 2/20 0.47
ALDH1A1 P00352 1/20 0.47
TCF4 P15884 1/20 0.46
CTNNB1 P35222 1/20 0.46
WDR5 P61964 2/20 0.46
MAPK1 P28482 1/20 0.45
MAPT P10636 1/20 0.45
GAA P10253 1/20 0.45
PFKFB3 Q16875 1/20 0.45
GPR27 Q9NS67 2/20 0.44

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
SCHEMBL6206246 1.00 MEN1 (0.53) MEN1KMT2APKMLMNAPOLB
SCHEMBL6206251 1.00 MEN1 (0.53) MEN1KMT2APKMLMNAPOLB
SCHEMBL6205252 0.90 KMT2A (0.59) MEN1KMT2ALMNAPOLBWDR5
SCHEMBL6205255 0.90 KMT2A (0.59) MEN1KMT2ALMNAPOLBWDR5
SCHEMBL6205259 0.90 KMT2A (0.59) MEN1KMT2ALMNAPOLBWDR5
SCHEMBL6206300 0.87 MEN1 (0.53) MEN1KMT2APKMLMNAPOLB
SCHEMBL6206304 0.87 MEN1 (0.53) MEN1KMT2APKMLMNAPOLB
SCHEMBL6204582 0.87 MEN1 (0.53) MEN1KMT2APKMLMNAPOLB
SCHEMBL6204503 0.85 HSD17B1 (0.52) MEN1KMT2ALMNAPOLBALDH1A1
SCHEMBL6205979 0.85 HSD17B1 (0.52) MEN1KMT2ALMNAPOLBALDH1A1

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-1100763-B1 DIKETOACID-DERIVATIVES AS INHIBITORS OF POLYMERASES ANGELETTI P IST RICHERCHE BIO (IT) 2005-06-22 EP claimed