SCHEMBL3549855

SCHEMBL3549855

O=C1CCC(c2ccc(NC(=O)O)cn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
WNT3A P56704 2/20 0.40
IDO1 P14902 2/20 0.39
PTPN2 P17706 2/20 0.38
PTPN1 P18031 2/20 0.38
DRD4 P21917 2/20 0.38
DRD2 P14416 1/20 0.38
DGAT1 O75907 4/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ESR2 Q92731 1/20 0.36
PDE10A Q9Y233 1/20 0.35
CYP2C8 P10632 1/20 0.35

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
SCHEMBL13009519 0.79 ROCK2 (0.50) NPC1RAB9A
SCHEMBL3540420 0.77 IDO1 (0.40) WNT3AIDO1DGAT1NPC1RAB9A
SCHEMBL23612049 0.77 IDO1 (0.39) WNT3AIDO1PTPN2PTPN1DGAT1
SCHEMBL21224957 0.76 ESR2 (0.58) IDO1NPC1RAB9AESR2
SCHEMBL16140168 0.75 NAMPT (0.49) WNT3AIDO1
SCHEMBL9998388 0.74 ESR2 (0.55) DRD4ESR2PDE10A
SCHEMBL25204037 0.74 OPRM1 (0.40) IDO1ESR2PDE10A
SCHEMBL15185493 0.74 RAB9A (0.57) NPC1RAB9A
SCHEMBL23195087 0.73 PTPN1 (0.47) WNT3AIDO1PTPN2PTPN1NPC1
SCHEMBL30152381 0.73 PTPN1 (0.47) WNT3AIDO1PTPN2PTPN1NPC1

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 5 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-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors ASTRAZENECA AB (SE) 2008-04-24 US 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 (2 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 WNT3A 3210/4885IDO1 2690/4885PTPN2 3503/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 WNT3A 3053/4885IDO1 2567/4885PTPN2 3635/4885

“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.