SCHEMBL671663

SCHEMBL671663

Cn1cc(-c2ccc(F)c(F)c2F)c(C=O)n1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
SSTR5 P35346 2/20 0.34
GRIN2B Q13224 7/20 0.33
PDE3B Q13370 2/20 0.32
PDE3A Q14432 2/20 0.32
ERN1 O75460 1/20 0.31
MAPK13 O15264 1/20 0.31
CSNK1D P48730 1/20 0.31
CSNK1E P49674 1/20 0.31
MAPK12 P53778 1/20 0.31
MAPK11 Q15759 1/20 0.31
MAPK14 Q16539 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL4833694 0.74 CSNK1D (0.53) MAPK13CSNK1DCSNK1EMAPK12MAPK11
SCHEMBL19312691 0.74
SCHEMBL16116264 0.70 KMT2A (0.40) MAPK13CSNK1DCSNK1EMAPK12MAPK11
SCHEMBL28659679 0.70 CSNK1D (0.33) MAPK13CSNK1DCSNK1EMAPK12MAPK11
SCHEMBL31336898 0.70 CSNK1D (0.44) MAPK13CSNK1DCSNK1EMAPK12MAPK11
SCHEMBL8110206 0.69 MAPK13 (0.50) ERN1MAPK13CSNK1DCSNK1EMAPK12
SCHEMBL2599825 0.69 CTSL (0.43) CTSLCTSSCTSKSSTR5GRIN2B
SCHEMBL8117446 0.68 GRM4 (0.38) PDE3BPDE3AMAPK13CSNK1DCSNK1E
SCHEMBL28648256 0.67 TGFBR1 (0.40) GRIN2BCSNK1DCSNK1E
SCHEMBL28648049 0.67 BRD4 (0.40)

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 9 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

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 CTSL 2666/4885CTSS 3531/4885CTSK 3328/4885

“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.