SCHEMBL3545205

SCHEMBL3545205

CC(C)(C)OC(=O)NCC1CCC(c2ccc(NC(=O)C(=O)O)cc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.55
NAMPT P43490 2/20 0.47
ACACB O00763 9/20 0.45
ACACA Q13085 5/20 0.45
DRD2 P14416 2/20 0.45
PBK Q96KB5 1/20 0.42
CKS1B P61024 1/20 0.42
SKP1 P63208 1/20 0.42
SKP2 Q13309 1/20 0.42
KMT2A Q03164 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
SCHEMBL3545203 1.00 PTPN11 (0.55) PTPN11NAMPTACACBACACADRD2
SCHEMBL3542146 0.91 ACACB (0.48) PTPN11NAMPTACACBACACADRD2
SCHEMBL3542148 0.91 ACACB (0.48) PTPN11NAMPTACACBACACADRD2
SCHEMBL13009671 0.90 NAMPT (0.46) PTPN11NAMPTACACBACACADRD2
SCHEMBL13009660 0.89 NAMPT (0.46) PTPN11NAMPTACACBACACADRD2
SCHEMBL7283438 0.83 DRD2 (0.50) ACACBACACADRD2PBKCKS1B
SCHEMBL13009667 0.83 HRH3 (0.52) NAMPTACACBACACADRD2
SCHEMBL13009670 0.82 DRD2 (0.49) ACACBACACADRD2PBKCKS1B
SCHEMBL31206034 0.79 DRD2 (0.44) NAMPTACACBACACADRD2PBK
SCHEMBL25042017 0.76 DRD2 (0.42) NAMPTACACBACACADRD2PBK

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 PTPN11 3606/4885NAMPT 165/4885ACACB 154/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 PTPN11 3612/4885NAMPT 161/4885ACACB 149/4885

“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.