SCHEMBL8788461

SCHEMBL8788461

O=C(O)CNS(=O)(=O)C1CCCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.38
EGLN1 Q9GZT9 2/20 0.38
HIF1AN Q9NWT6 2/20 0.38
BBOX1 O75936 1/20 0.38
ASPH Q12797 1/20 0.38
KDM8 Q8N371 1/20 0.38
TBXA2R P21731 1/20 0.38
APEX1 P27695 1/20 0.38
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MMP1 P03956 2/20 0.36
MMP12 P39900 2/20 0.36
MMP7 P09237 1/20 0.36
ECE1 P42892 1/20 0.36
MMP13 P45452 1/20 0.36
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KMT2A Q03164 2/20 0.34
OGFOD1 Q8N543 1/20 0.34
EGLN2 Q96KS0 1/20 0.34

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
SCHEMBL8789191 1.00 TBXAS1 (0.38) TBXAS1EGLN1HIF1ANBBOX1ASPH
SCHEMBL8788740 1.00 TBXAS1 (0.38) TBXAS1EGLN1HIF1ANBBOX1ASPH
SCHEMBL13783852 0.82 MMP1 (0.44) TBXA2RMMP1MMP12MMP7ECE1
SCHEMBL25872303 0.81 CES2 (0.37) TBXAS1EGLN1HIF1ANBBOX1ASPH
SCHEMBL25871136 0.81 CES2 (0.37) TBXAS1EGLN1HIF1ANBBOX1ASPH
SCHEMBL11308021 0.79 EPHX2 (0.47) TBXA2RALDH1A1MMP1MMP12MMP7
SCHEMBL31522357 0.75 EPHX1 (0.51) TBXAS1TBXA2RALDH1A1L3MBTL1EPHX2
SCHEMBL8224007 0.73 CA1 (0.39) TBXA2RALDH1A1MMP1MMP12MMP7
SCHEMBL1768677 0.73 GRIK1 (0.40) TBXA2RALDH1A1MMP1MMP12MMP7
SCHEMBL1768679 0.73 GRIK1 (0.40) TBXA2RALDH1A1MMP1MMP12MMP7

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-0788796-A1 URICOSURIC AGENT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-08-13 EP disclosed