SCHEMBL3345126

SCHEMBL3345126

OCCCOC1CCCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.48
NAAA Q02083 2/20 0.40
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
EPHX1 P07099 2/20 0.32

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
SCHEMBL386704 1.00 NPC1 (0.48) NPC1NAAACA12CA1CA2
SCHEMBL1444884 0.98 NPC1 (0.45) NPC1NAAACA12CA1CA2
SCHEMBL1258617 0.93 NPC1 (0.47) NPC1NAAACA12CA1CA2
SCHEMBL1901243 0.91 NPC1 (0.45) NPC1NAAAEPHX1
SCHEMBL8614030 0.91 NPC1 (0.45) NPC1NAAAEPHX1
SCHEMBL3752919 0.91 NPC1 (0.43) NPC1NAAAEPHX1
SCHEMBL470896 0.87
SCHEMBL10684690 0.87 NPC1 (0.33) NPC1
SCHEMBL8133074 0.87 NAAA (0.40) NPC1NAAACA1CA2EPHX1
SCHEMBL22124333 0.86 NPC1 (0.39) NPC1NAAA

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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2010-12-16 US disclosed
US-7795283-B2 Oxadiazole derivative as DGAT inhibitors ASTRAZENECA AB (SE) 2010-09-14 US disclosed
US-20100160397-A1 OXAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DIABETES AND OBESITY ASTRAZENECA AB (SE) 2010-06-24 US disclosed
US-20090209602-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2009-08-20 US disclosed
EP-2035397-A1 CHEMICAL COMPOUNDS Astra Zeneca AB (SE) 2009-03-18 EP disclosed
EP-2032546-A1 OXAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DIABETES AND OBESITY Astra Zeneca AB (SE) 2009-03-11 EP disclosed
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors ASTRAZENECA AB (SE) 2008-04-24 US disclosed
WO-2007141502-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2007-12-13 WO disclosed
WO-2007141538-A1 OXAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DIABETES AND OBESITY ASTRAZENECA AB (SE) 2007-12-13 WO disclosed
EP-1833806-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS AstraZeneca AB (SE) 2007-09-19 EP disclosed
WO-2006064189-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 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 (4 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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS DGAT1, DGAT2, GPR119 NPC1 423/4885NAAA 1518/4885CA12 4830/4885
US-20090209602-A1 CHEMICAL COMPOUNDS DGAT1, ACAT2, DGAT2 NPC1 188/4885NAAA 137/4885CA12 3411/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 NPC1 399/4885NAAA 1469/4885CA12 4826/4885
US-20100160397-A1 OXAZOLE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DIABETES AND OBESITY DGAT1, ACAT1, DGAT2 NPC1 723/4885NAAA 215/4885CA12 3222/4885

“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.