SCHEMBL13008767

SCHEMBL13008767

COC(=O)C1CC(c2ccc(C(C)(C)C)cc2)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 2/20 0.54
▸ S1PR1 P21453 3/20 0.42
▸ CYP3A4 P08684 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MGLL Q99685 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ RAB9A P51151 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ CHRNB2 P17787 2/20 0.39

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
SCHEMBL13008709 0.91 SLC6A2 (0.55) SLC6A2S1PR1CYP3A4MAPTGAA
SCHEMBL7959825 0.86 TDP1 (0.48) SLC6A2CYP3A4MAPTGAAALDH1A1
SCHEMBL7959820 0.86 TDP1 (0.48) SLC6A2CYP3A4MAPTGAAALDH1A1
SCHEMBL30389049 0.86 SLC6A2 (0.56) SLC6A2S1PR1CYP3A4MAPTGAA
SCHEMBL30389265 0.86 SLC6A2 (0.56) SLC6A2S1PR1CYP3A4MAPTGAA
SCHEMBL23605146 0.86 SLC6A2 (0.56) SLC6A2S1PR1CYP3A4MAPTGAA
SCHEMBL10690266 0.81 AKR1C3 (0.47) SLC6A2S1PR1MGLLGAAALDH1A1
SCHEMBL10693605 0.81 RAB9A (0.43) SLC6A2MGLLGAAALDH1A1LMNA
SCHEMBL2722339 0.80 NAAA (0.53) SLC6A2ALDH1A1RAB9ANPC1
SCHEMBL21512716 0.80 SLC6A3 (0.50) SLC6A2CHRNB2CHRNA4CHRNB4CHRNA3

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 3 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

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 SLC6A2 775/4885S1PR1 2815/4885CYP3A4 551/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 SLC6A2 770/4885S1PR1 2931/4885CYP3A4 544/4885

“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.

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