SCHEMBL7372020

SCHEMBL7372020

COC(=O)c1cccc2nc(-c3cccc(S(=O)(=O)Nc4ccccc4Cl)c3)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
TSHR P16473 1/20 0.46
PTK2B Q14289 1/20 0.46
MAPT P10636 6/20 0.46
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 0.45
LMNA P02545 5/20 0.45
MAPK1 P28482 4/20 0.45
HSD17B10 Q99714 1/20 0.45
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 2/20 0.43
PKM P14618 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GAA P10253 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
SLC40A1 Q9NP59 2/20 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
SCHEMBL7371489 0.90 KDM4E (0.54) KDM4ETSHRPTK2BMAPTKMT2A
SCHEMBL697780 0.77 KDM4E (0.54) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL7375606 0.77 ACLY (0.46) TSHRMAPTKMT2AMEN1LMNA
SCHEMBL10212480 0.75 KDM4E (0.55) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL7371484 0.74 ACLY (0.53) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL6926045 0.71 MAPT (0.67) KDM4ETSHRPTK2BMAPTKMT2A
SCHEMBL29087625 0.71 KDM4E (0.52) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL7375039 0.70 PTPN2 (0.56) MAPTKMT2AMEN1LMNAMAPK1
SCHEMBL7374089 0.70 CHEK2 (0.55) MAPTKMT2AMEN1LMNATP53
SCHEMBL7370125 0.69 MAPT (0.49) MAPTKMT2AMEN1LMNATP53

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-2001074786-A1 HETEROBIARYLSULPHONAMIDES AND THEIR USE AS PDE 7 INHIBITORS DARWIN DISCOVERY LIMITED (GB) 2001-10-11 WO disclosed