SCHEMBL3542306

SCHEMBL3542306

CC(C(=O)O)C1(c2cc[c]cc2)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 14/20 0.40
SLC6A3 Q01959 14/20 0.40
SLC6A2 P23975 4/20 0.40
HDAC4 P56524 2/20 0.35
PPARA Q07869 1/20 0.34
CHRM3 P20309 1/20 0.33
AKR1C1 Q04828 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
SCHEMBL14899045 0.83 AKR1C1 (0.48) SLC6A4SLC6A3SLC6A2HDAC4AKR1C1
SCHEMBL3540548 0.81 SLC6A4 (0.37) SLC6A4SLC6A3SLC6A2PPARA
SCHEMBL4249913 0.79 SLC6A4 (0.58) SLC6A4SLC6A3SLC6A2HDAC4
SCHEMBL28207270 0.77 OPRM1 (0.36) HDAC4PPARAAKR1C1
SCHEMBL16341900 0.75 SLC6A4 (0.37) SLC6A4SLC6A3SLC6A2
SCHEMBL16341922 0.75 OPRM1 (0.38) SLC6A4SLC6A3SLC6A2
SCHEMBL28776197 0.75 SLC6A4 (0.50) SLC6A4SLC6A3SLC6A2HDAC4CHRM3
SCHEMBL3542301 0.74 SLC6A3 (0.37) SLC6A4SLC6A3SLC6A2HDAC4CHRM3
SCHEMBL27742158 0.73 AKR1C1 (0.48) SLC6A4SLC6A3SLC6A2HDAC4AKR1C1
SCHEMBL4283830 0.72 SLC6A4 (0.51) SLC6A4SLC6A3SLC6A2HDAC4AKR1C1

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 10 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
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 SLC6A4 886/4885SLC6A3 413/4885SLC6A2 775/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 SLC6A4 844/4885SLC6A3 363/4885SLC6A2 770/4885

“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.