SCHEMBL8886947

SCHEMBL8886947

COC(=O)c1sc2cccc(NC=O)c2c1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.55
ALDH1A1 P00352 9/20 0.55
MAPT P10636 6/20 0.55
GLA P06280 4/20 0.55
HPGD P15428 4/20 0.55
HSD17B10 Q99714 4/20 0.55
GAA P10253 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALOX15 P16050 2/20 0.55
ATM Q13315 1/20 0.55
MAPK1 P28482 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TSHR P16473 1/20 0.47
CASP1 P29466 1/20 0.44
HTT P42858 1/20 0.44
CASP7 P55210 1/20 0.44
NCOA1 Q15788 1/20 0.44
RCE1 Q9Y256 1/20 0.44
NCOA3 Q9Y6Q9 1/20 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
SCHEMBL8143138 0.78 KDM4E (0.57) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL4343748 0.78 ALDH1A1 (0.73) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL2748825 0.78 ALDH1A1 (0.73) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL7218005 0.78 KDM4E (0.60) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL8242765 0.76 ALDH1A1 (0.57) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL24853492 0.75 ALDH1A1 (0.56) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL30173777 0.71 KDM4E (1.00) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL1101766 0.71 KDM4E (1.00) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL8143031 0.71 KDM4E (0.58) KDM4EALDH1A1MAPTGLAHPGD
SCHEMBL8128525 0.71 KDM4E (0.58) KDM4EALDH1A1MAPTGLAHPGD

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-5597823-A TREATING BENIGN PROSTATIC HYPERPLASIA ABBOTT LABORATORIES (US) 1997-01-28 US disclosed