SCHEMBL11355440

SCHEMBL11355440

Cc1ccc(C2Sc3ccccc3NC(=O)C2COS(C)(=O)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
KDM4E B2RXH2 3/20 0.46
HTT P42858 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 4/20 0.45
USP2 O75604 1/20 0.45
ESR1 P03372 1/20 0.45
POLB P06746 1/20 0.45
THRB P10828 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
PTPN7 P35236 1/20 0.45
RECQL P46063 1/20 0.45
ESR2 Q92731 1/20 0.45

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
SCHEMBL11353409 0.86 HSD17B10 (0.48) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11351992 0.81 HSD17B10 (0.54) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL10897219 0.74 HSD17B10 (0.79) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11021035 0.74 HSD17B10 (0.79) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11021033 0.74 HSD17B10 (0.79) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11358993 0.74 KDM4E (0.46) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11358989 0.74 KDM4E (0.46) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11358996 0.74 KDM4E (0.46) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11359504 0.73 KDM4E (0.65) MAPTKDM4EHTTTDP1SMN1; SMN2
SCHEMBL11355400 0.71 HSD17B10 (0.51) MAPTKDM4EHTTTDP1SMN1; SMN2

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
US-4264497-A ANTICHOLINERGIC, ANTISPASMODIC, ANTIULCER AND ANTISECRETORY AGENTS MARUKO SEIYAKU CO., LTD. (JP) 1981-04-28 US disclosed