SCHEMBL3545246

SCHEMBL3545246

O=C(Nc1ccc(N2CCOCC2)cc1)c1nnc(Nc2cccc(OCc3ccccc3)c2)o1

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 16/20 0.83
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
MAPT P10636 2/20 0.54
USP2 O75604 1/20 0.54
MAPK1 P28482 1/20 0.54
ESR2 Q92731 1/20 0.54
TAAR1 Q96RJ0 1/20 0.54
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL3541653 0.91 DGAT1 (1.00) DGAT1
SCHEMBL3538940 0.90 DGAT1 (0.69) DGAT1KMT2AMEN1MAPTUSP2
SCHEMBL3543763 0.88 DGAT1 (0.65) DGAT1KMT2AMEN1MAPTUSP2
SCHEMBL3542205 0.84 DGAT1 (1.00) DGAT1
SCHEMBL3545441 0.84 DGAT1 (0.73) DGAT1
SCHEMBL3544685 0.82 DGAT1 (0.79) DGAT1KMT2AMEN1
SCHEMBL3540099 0.82 DGAT1 (0.84) DGAT1
SCHEMBL3544122 0.82 DGAT1 (0.79) DGAT1KMT2AMEN1MAPTKDM4E
SCHEMBL3544566 0.81 DGAT1 (0.64) DGAT1
SCHEMBL3543662 0.81 MAPT (0.70) DGAT1KMT2AMEN1MAPTUSP2

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 1/4885KMT2A 1509/4885MEN1 3064/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 DGAT1 1/4885KMT2A 1490/4885MEN1 3095/4885

“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.