SCHEMBL3550690

SCHEMBL3550690

NCC1(c2[c]cccc2)CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.52
SLC6A3 Q01959 14/20 0.49
SLC6A4 P31645 13/20 0.49
SLC6A2 P23975 6/20 0.49
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41

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
SCHEMBL21899380 0.82 SLC6A4 (0.39) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL21899361 0.79 SLC6A4 (0.37) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL3545670 0.79 HSD11B1 (0.35) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL3545965 0.78 TSHR (0.36) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL11210776 0.78 MEN1 (0.37) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL2656474 0.77 CETP (0.37) SLC6A3SLC6A4SLC6A2
SCHEMBL3542554 0.77 HSD11B1 (0.49) DPP4SLC6A3SLC6A4SLC6A2
SCHEMBL21899371 0.76 CNR1 (0.40) SLC6A3SLC6A4SLC6A2
SCHEMBL379632 0.75 ESR1 (0.34) SLC6A3SLC6A4SLC6A2
SCHEMBL3545187 0.75 HSD11B1 (0.46) DPP4

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 8 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 claimed
US-7795283-B2 Oxadiazole derivative as DGAT inhibitors ASTRAZENECA AB (SE) 2010-09-14 US claimed
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors ASTRAZENECA AB (SE) 2008-04-24 US claimed
EP-1833806-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS AstraZeneca AB (SE) 2007-09-19 EP claimed
WO-2006064189-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2006-06-22 WO claimed
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

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 DPP4 328/4885SLC6A3 413/4885SLC6A4 886/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 DPP4 177/4885SLC6A3 363/4885SLC6A4 844/4885

“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.