SCHEMBL8260235

SCHEMBL8260235

CCCCOC(=O)NC1CCC(C)CC1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
EPHX1 P07099 4/20 0.49
NAAA Q02083 2/20 0.44
ACHE P22303 5/20 0.42

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
SCHEMBL8257128 1.00 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL8259162 1.00 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL13387564 0.93 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL4719490 0.93 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL16526220 0.88 GAA (0.66) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL2575225 0.87 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL4282209 0.87 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL4282204 0.87 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL28019672 0.87 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL1827279 0.86 EPHX1 (0.64) GAAMAPK1HTTSMN1; SMN2EPHX1

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
US-9199946-B2 Pyrimidinone carboxamide inhibitors of endothelial lipase BRISTOL-MYERS SQUIBB COMPANY (US) 2015-12-01 US disclosed
US-20150065505-A1 PYRIMIDINONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2015-03-05 US disclosed
CN-103391813-A Catalyst for isocyanate compound production and method for producing isocyanate compound using same UBE INDUSTRIES 2013-11-13 CN disclosed
WO-2013151877-A1 PYRIMIDINEDIONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE BRISTOL-MYERS SQUIBB COMPANY (US) 2013-10-10 WO disclosed
CN-102046589-A Low chlorine, multi-staged method for producing cycloaliphatic diisocyanates EVONIK DEGUSSA GMBH 2011-05-04 CN disclosed
EP-2228364-A1 Acylsulfonamides as inhibitors of steroid sulfatase Novartis AG (CH) 2010-09-15 EP disclosed
US-20090227620-A1 ANTI-INFLAMMATORY COMPOUNDS MEINGASSNER JOSEF GOTTFRIED 2009-09-10 US disclosed
US-7482462-B2 Acylsulfonamides as inhibitors of steroid sulfatase NOVARTIS AG (CH) 2009-01-27 US disclosed
US-20080293758-A1 Combination of a Steroid Sulfatase Inhibitor and an Ascomycin NOVARTIS AG (CH) 2008-11-27 US disclosed
CN-101234998-A Process for the continuous preparation of (cyclo) aliphatic diisocyanates EVONIK DEGUSSA GMBH (DE) 2008-08-06 CN disclosed
WO-2006097293-A2 COMBINATION OF A STEROID SULFATASE INHIBITOR AND AN ASCOMYCIN NOVARTIS AG (CH) 2006-09-21 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 (3 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-20080293758-A1 Combination of a Steroid Sulfatase Inhibitor and an Ascomycin STS, ARSA, CYP17A1 GAA 204/4885MAPK1 3743/4885HTT 4113/4885
US-20090227620-A1 ANTI-INFLAMMATORY COMPOUNDS STS, SERPINB1, MPO GAA 217/4885MAPK1 2555/4885HTT 3704/4885
US-20150065505-A1 PYRIMIDINONE CARBOXAMIDE INHIBITORS OF ENDOTHELIAL LIPASE LIPG, LPL, PNLIP GAA 43/4885MAPK1 3689/4885HTT 4794/4885

“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.