SCHEMBL3539892

SCHEMBL3539892

NNC(=O)C(=O)Nc1ccc(N2CCC(CC(=O)O)CC2)nc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.45
JAK2 O60674 2/20 0.45
DGAT1 O75907 12/20 0.45
CYP3A4 P08684 1/20 0.45
SOAT1 P35610 1/20 0.45
ACAT1 P24752 1/20 0.45
DEGS1 O15121 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
KCNH2 Q12809 3/20 0.42
MCHR1 Q99705 1/20 0.41
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL13009516 0.88 DGAT1 (0.46) JAK2DGAT1CYP3A4SOAT1DEGS1
SCHEMBL3538892 0.85 MAPT (0.47) DGAT1KDM4EMAPTKCNH2MCHR1
SCHEMBL3543293 0.80 KDM4E (0.52) DGAT1KDM4EMAPTRAB9AL3MBTL1
SCHEMBL3545445 0.79 DHODH (0.39) DGAT1CYP3A4KDM4E
SCHEMBL3540578 0.79 DGAT1 (0.44) DGAT1SOAT1KDM4E
SCHEMBL3540582 0.79 DGAT1 (0.44) DGAT1SOAT1KDM4E
SCHEMBL3537299 0.79 DGAT1 (0.49) DGAT1CYP3A4SOAT1ACAT1DEGS1
SCHEMBL3541406 0.78 DGAT1 (0.57) DGAT1KDM4EL3MBTL1
SCHEMBL4500215 0.78 MAPT (0.61) DGAT1MAPTRAB9A
SCHEMBL3542683 0.78 DGAT1 (0.48) SYKJAK2DGAT1DEGS1KDM4E

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 SYK 3890/4885JAK2 2560/4885DGAT1 1/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 SYK 4010/4885JAK2 2557/4885DGAT1 1/4885

“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.