SCHEMBL8529522

SCHEMBL8529522

CS(=O)(=O)OC[C@H]1OC2(CCCCC2)O[C@@H]1COS(C)(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 7/20 0.38
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MMP9 P14780 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL8529379 1.00 CA2 (0.38) CA2CA1CA9POLBGAA
SCHEMBL8529063 0.98 CA2 (0.36) CA2CA1CA9KDM4EUSP2
SCHEMBL8533385 0.98 CA2 (0.36) CA2CA1CA9KDM4EUSP2
SCHEMBL9364290 0.92 CA2 (0.34) CA2POLBGAAMAPK1NPSR1
SCHEMBL9364293 0.90 CA2 (0.33) CA2CA1CA9
SCHEMBL9360120 0.90 CA2 (0.33) CA2CA1CA9
SCHEMBL9364924 0.84 CA2 (0.34) CA2CA1CA9POLBGAA
SCHEMBL8529382 0.79 CA2 (0.44) CA2CA1CA9KDM4EUSP2
SCHEMBL8533841 0.79 CA2 (0.44) CA2CA1CA9KDM4EUSP2
SCHEMBL24410879 0.79 CA2 (0.35) CA2POLBGAAMAPK1NPSR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586378-B1 NOVEL PLATINUM(II) COMPLEX AND PROCESSES FOR PREPARING THE SAME SUNKYONG IND LTD (KR) 1998-09-23 EP disclosed
US-5395947-A Antitumor agents SUNKYONG INDUSTRIES, LTD. (KR) 1995-03-07 US disclosed
EP-0586378-A1 NOVEL PLATINUM(II) COMPLEX AND PROCESSES FOR PREPARING THE SAME SUNKYONG INDUSTRIES LTD. (KR) 1994-03-16 EP disclosed
WO-1992016539-A1 NOVEL PLATINUM(II) COMPLEX AND PROCESSES FOR PREPARING THE SAME SUNKYONG INDUSTRIES LTD. (KR) 1992-10-01 WO disclosed