SCHEMBL672434

SCHEMBL672434

CC(C)n1cc(C=O)c2c(-c3ccc(F)c(F)c3F)cccc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 1/20 0.41
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MITF O75030 1/20 0.33
USP2 O75604 1/20 0.33
RAB9A P51151 1/20 0.33
ERN1 O75460 1/20 0.32
ALDH1A1 P00352 3/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
HTR1B P28222 1/20 0.30
IMPDH2 P12268 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
SCHEMBL14957551 0.86 MEN1 (0.37) MEN1KMT2AMITFUSP2RAB9A
SCHEMBL671036 0.84 MEN1 (0.33) MEN1KMT2AMITFUSP2RAB9A
SCHEMBL14957743 0.80 NFATC1 (0.37) MEN1KMT2AMITFUSP2RAB9A
SCHEMBL672431 0.80 ALDH1A1 (0.38) MEN1KMT2AALDH1A1HTR1B
SCHEMBL14957219 0.78 AKR1C3 (0.35) MEN1KMT2AMITFUSP2RAB9A
SCHEMBL672439 0.77 CTSL (0.35) CTSLCTSSCTSKERN1
SCHEMBL670862 0.75 CYP3A4 (0.34) MEN1KMT2AERN1ALDH1A1LMNA
SCHEMBL671614 0.75 ALDH1A1 (0.32) MEN1KMT2AALDH1A1
SCHEMBL673549 0.74 SSTR5 (0.42) SSTR5MEN1KMT2AMITFUSP2
SCHEMBL672866 0.73 CYP2A6 (0.41) MEN1KMT2AMITFUSP2RAB9A

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 11 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
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 SSTR5 1/4885CTSL 2666/4885CTSS 3531/4885

“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.