SCHEMBL3540579

SCHEMBL3540579

O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1nnc(Nc2ccccc2)o1

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 17/20 0.82
HTT P42858 1/20 0.58
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
KMT2A Q03164 1/20 0.56

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
SCHEMBL3538069 0.93 DGAT1 (0.78) DGAT1HTTNPC1RAB9AKMT2A
SCHEMBL3547014 0.92 DGAT1 (0.75) DGAT1HTTNPC1RAB9AKMT2A
SCHEMBL3545114 0.91 DGAT1 (0.75) DGAT1HTTNPC1RAB9AKMT2A
SCHEMBL3544733 0.91 DGAT1 (0.75) DGAT1HTTNPC1RAB9AKMT2A
SCHEMBL3540550 0.91 DGAT1 (0.78) DGAT1HTTNPC1RAB9AKMT2A
SCHEMBL5250348 0.91 DGAT1 (0.72) DGAT1HTTKMT2A
SCHEMBL3545486 0.91 DGAT1 (0.77) DGAT1HTTNPC1RAB9AKMT2A
SCHEMBL3540411 0.90 DGAT1 (1.00) DGAT1HTT
SCHEMBL3537324 0.90 DGAT1 (0.73) DGAT1HTTNPC1RAB9AKMT2A
SCHEMBL3547406 0.90 DGAT1 (0.73) DGAT1HTTNPC1RAB9AKMT2A

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 DGAT1 1/4885HTT 1370/4885NPC1 423/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 DGAT1 1/4885HTT 1275/4885NPC1 399/4885

“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.