SCHEMBL3538579

SCHEMBL3538579

COC(=O)C1(c2[c]cccc2)CCCC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
HDAC4 P56524 6/20 0.39
AKR1C1 Q04828 1/20 0.39
APOBEC3A P31941 3/20 0.36
APOBEC3G Q9HC16 3/20 0.36
CYP3A4 P08684 2/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HSD11B1 P28845 1/20 0.36
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35
PRCP P42785 1/20 0.35
SIGMAR1 Q99720 1/20 0.35

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
SCHEMBL3545426 0.97 CHRM3 (0.37) CHRM3L3MBTL1HDAC4AKR1C1APOBEC3A
SCHEMBL28986623 0.94 MEN1 (0.38) CHRM3CYP3A4TSHRHTTMEN1
SCHEMBL3543714 0.80 AKR1C1 (0.56) L3MBTL1HDAC4AKR1C1TSHRHTT
SCHEMBL3539518 0.79 AKR1C1 (0.55) CHRM3L3MBTL1HDAC4AKR1C1TSHR
SCHEMBL3538431 0.77 AKR1C1 (0.52) L3MBTL1HDAC4AKR1C1HTTMEN1
SCHEMBL3542721 0.76 CYP3A4 (0.38) CHRM3L3MBTL1HDAC4APOBEC3AAPOBEC3G
SCHEMBL27987684 0.76 AKR1C1 (0.38) HDAC4AKR1C1TSHRHTTMEN1
SCHEMBL1041983 0.75 AKR1C1 (0.63) CHRM3L3MBTL1HDAC4AKR1C1APOBEC3A
SCHEMBL3548276 0.74 ALDH1A1 (0.36) L3MBTL1MEN1KMT2A
SCHEMBL1042365 0.73 HDAC4 (0.62) CHRM3L3MBTL1HDAC4AKR1C1APOBEC3A

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 CHRM3 4449/4885L3MBTL1 1959/4885HDAC4 1043/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 CHRM3 4384/4885L3MBTL1 2007/4885HDAC4 895/4885

“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.