SCHEMBL17079052

SCHEMBL17079052

CS(=O)(=O)OCCc1cocn1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MMP9 P14780 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HRH4 Q9H3N8 1/20 0.33
NAMPT P43490 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
SCHEMBL3710293 0.82 HRH4 (0.34) KDM4EUSP2ALDH1A1LMNAMMP9
Hydrochloric Acid SCHEMBL16794938 0.81 HRH4 (0.33) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL9373283 0.71 LMNA (0.36) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL1044520 0.69 LMNA (0.55) KDM4EALDH1A1LMNAALOX15
SCHEMBL27247043 0.69 KDM4E (0.38) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL23416989 0.69 ALDH1A1 (0.38) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL21942857 0.69 XDH (0.39) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL21855356 0.69 KDM4E (0.34) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL278398 0.68 NOS3 (0.38) HRH4NAMPT
SCHEMBL13673114 0.68 TSHR (0.51) KDM4EUSP2ALDH1A1LMNAMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3116859-B1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2018-08-01 EP disclosed
EP-3116859-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2017-01-18 EP disclosed
WO-2015137750-A1 NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2015-09-17 WO disclosed