SCHEMBL6964461

SCHEMBL6964461

COC(=O)c1ccccc1COS(=O)(=S)c1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.47
▸ ALDH1A1 P00352 6/20 0.45
▸ LMNA P02545 3/20 0.45
▸ KMT2A Q03164 6/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ POLB P06746 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA5A P35218 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RORC P51449 1/20 0.40
▸ PSMD14 O00487 1/20 0.40
▸ MMP2 P08253 1/20 0.40

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
SCHEMBL6966156 0.79 MEN1 (0.51) ALDH1A1KMT2AMEN1L3MBTL1HTT
SCHEMBL6964289 0.79 SMN1; SMN2 (0.46) ALDH1A1LMNAKMT2AMEN1KDM4E
SCHEMBL6184555 0.78 ALDH1A1 (0.54) ALDH1A1LMNAKMT2AL3MBTL1KDM4E
SCHEMBL15227216 0.77 LMNA (0.51) FFAR4ALDH1A1LMNAKMT2AMEN1
SCHEMBL20981435 0.76 MEN1 (0.63) FFAR4ALDH1A1LMNAKMT2AMEN1
SCHEMBL6964455 0.75 BCHE (0.54) FFAR4ALDH1A1LMNAKMT2AMEN1
SCHEMBL15286510 0.75 ALDH1A1 (0.51) FFAR4ALDH1A1LMNAKMT2AMEN1
SCHEMBL6964974 0.75 MAPT (0.61) ALDH1A1KMT2AKDM4EMAPTPOLB
SCHEMBL9432132 0.73 CA9 (0.50) ALDH1A1LMNAKMT2AL3MBTL1MAPT
SCHEMBL11709342 0.73 KMT2A (0.44) ALDH1A1LMNAKMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0729465-B1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE DAVIS & CO (US) 2003-01-22 — — EP disclosed
EP-0729466-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1996-09-04 — — EP disclosed
EP-0729465-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1996-09-04 — — EP disclosed
WO-1995014013-A1 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1995-05-26 — — WO disclosed
WO-1995014014-A2 PYRONE DERIVATIVES AS PROTEASE INHIBITORS AND ANTIVIRAL AGENTS PARKE, DAVIS & COMPANY (US) 1995-05-26 — — WO disclosed
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