SCHEMBL670268

SCHEMBL670268

CC1(C)CCS(=O)(=O)c2ccc(C=O)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOX P28300 1/20 0.37
SSTR5 P35346 1/20 0.36
RARB P10826 7/20 0.35
RARG P13631 7/20 0.35
RARA P10276 6/20 0.35
RXRA P19793 3/20 0.33
ALDH1A1 P00352 6/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
KDM4E B2RXH2 2/20 0.31
RAB9A P51151 2/20 0.31
CYP26A1 O43174 2/20 0.31
PTGS2 P35354 1/20 0.31
NPC1 O15118 1/20 0.31
GMNN O75496 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 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
SCHEMBL21032174 0.84 ALDH1A1 (0.33) RARBRARGRARAALDH1A1TSHR
SCHEMBL21028302 0.81 PTGDR2 (0.36) ALDH1A1HSD17B10TDP1KDM4ERAB9A
SCHEMBL8293679 0.79 LOX (0.39) LOXSSTR5RXRAALDH1A1TDP1
SCHEMBL9144018 0.77 RARB (0.54) SSTR5RARBRARGRARARXRA
SCHEMBL12715259 0.75 RXRA (0.38) LOXSSTR5RARBRARGRARA
SCHEMBL3838099 0.74 RARB (0.57) RARBRARGRARARXRAALDH1A1
SCHEMBL20921325 0.73 LOX (0.41) LOXSSTR5
SCHEMBL2599798 0.73 ALDH1A1 (0.33) LOXALDH1A1
SCHEMBL8776414 0.72 RARG (0.54) RARBRARGRARARXRAALDH1A1
SCHEMBL18741109 0.71 RARB (0.40) RARBRARGRARARXRAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2605658-B1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME (US) 2016-03-23 EP disclosed
US-8742110-B2 Spiroxazolidinone compounds MERCK SHARP & DOHME CORP. (US) 2014-06-03 US disclosed
US-8742110-B2 Spiroxazolidinone compounds MERCK SHARP & DOHME CORP. (US) 2014-06-03 US disclosed
US-8742110-B2 Spiroxazolidinone compounds MERCK SHARP & DOHME CORP. (US) 2014-06-03 US disclosed
EP-2605658-A1 SPIROXAZOLIDINONE COMPOUNDS Merck Sharp & Dohme Corp. (US) 2013-06-26 EP disclosed
US-20130131042-A1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2013-05-23 US disclosed
US-20130131042-A1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2013-05-23 US disclosed
US-20130131042-A1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2013-05-23 US disclosed
WO-2012024183-A1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2012-02-23 WO disclosed
WO-2012024183-A1 SPIROXAZOLIDINONE COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2012-02-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130131042-A1 SPIROXAZOLIDINONE COMPOUNDS SSTR5, SSTR2, SSTR4 LOX 1836/4885SSTR5 1/4885RARB 2563/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.