SCHEMBL8529382

SCHEMBL8529382

CC1(C)O[C@@H](COS(C)(=O)=O)[C@H](COS(C)(=O)=O)O1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.44
CA1 P00915 2/20 0.44
CA9 Q16790 2/20 0.44
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MMP9 P14780 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
PGD P52209 1/20 0.33
CA12 O43570 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA7 P43166 1/20 0.31
CA13 Q8N1Q1 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL8533841 1.00 CA2 (0.44) CA2CA1CA9KDM4EUSP2
SCHEMBL9364914 0.91 CA2 (0.39) CA2CA1CA9KDM4EUSP2
SCHEMBL17801225 0.88 CA2 (0.40) CA2CA1CA9KDM4EUSP2
SCHEMBL15892813 0.88 CA2 (0.37) CA2CA1CA9
SCHEMBL7171854 0.82 CA2 (0.34) CA2CA1CA9KDM4EUSP2
SCHEMBL8529633 0.82 CA2 (0.34) CA2CA1CA9KDM4EUSP2
SCHEMBL7172461 0.82 CA2 (0.34) CA2CA1CA9KDM4EUSP2
SCHEMBL8529063 0.80 CA2 (0.36) CA2CA1CA9KDM4EUSP2
SCHEMBL8533385 0.80 CA2 (0.36) CA2CA1CA9KDM4EUSP2
SCHEMBL8529394 0.80 CA2 (0.33) CA2CA1CA9KDM4EUSP2

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