SCHEMBL3545674

SCHEMBL3545674

NC(=O)CC1(c2cc[c]cc2)CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.47
SLC6A3 Q01959 6/20 0.38
SLC6A4 P31645 5/20 0.38
DPP4 P27487 1/20 0.37
SLC6A2 P23975 2/20 0.36
LMNA P02545 3/20 0.36
HSD17B10 Q99714 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL3542558 0.85 HSD11B1 (0.66) HSD11B1SLC6A3SLC6A4DPP4SLC6A2
SCHEMBL17761202 0.83 DPP4 (0.56) HSD11B1SLC6A3SLC6A4DPP4SLC6A2
SCHEMBL3545191 0.83 HSD11B1 (0.63) HSD11B1DPP4LMNAHSD17B10L3MBTL1
SCHEMBL4866308 0.81 DPP4 (0.58) HSD11B1SLC6A3SLC6A4DPP4SLC6A2
SCHEMBL6491320 0.80 HSD11B1 (0.51) HSD11B1SLC6A3SLC6A4SLC6A2LMNA
SCHEMBL17761297 0.80 HSD11B1 (0.73) HSD11B1SLC6A3SLC6A4SLC6A2
SCHEMBL12836593 0.80 SLC6A3 (0.62) HSD11B1SLC6A3SLC6A4SLC6A2
SCHEMBL17761201 0.80 HSD11B1 (0.51) HSD11B1SLC6A3SLC6A4SLC6A2L3MBTL1
SCHEMBL3548281 0.80 HSD11B1 (0.44) HSD11B1SLC6A3SLC6A4SLC6A2LMNA
SCHEMBL3543773 0.80 HSD11B1 (0.44) HSD11B1SLC6A3SLC6A4SLC6A2LMNA

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 6 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
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 HSD11B1 117/4885SLC6A3 413/4885SLC6A4 886/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 HSD11B1 126/4885SLC6A3 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.