SCHEMBL3539822

SCHEMBL3539822

CC1(CC(=O)O)CCN(c2ccc(N)cn2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.41
▸ TACR1 P25103 1/20 0.41
▸ GRIN2D O15399 1/20 0.40
▸ GRIN3B O60391 1/20 0.40
▸ GRIN1 Q05586 1/20 0.40
▸ GRIN2A Q12879 1/20 0.40
▸ GRIN2B Q13224 1/20 0.40
▸ GRIN2C Q14957 1/20 0.40
▸ GRIN3A Q8TCU5 1/20 0.40
▸ OPRD1 P41143 1/20 0.39
▸ PTPN11 Q06124 2/20 0.39
▸ CRBN Q96SW2 2/20 0.37
▸ UBE2T Q9NPD8 1/20 0.37
▸ OGA O60502 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ME2 P23368 2/20 0.36
▸ ME1 P48163 2/20 0.36
▸ ME3 Q16798 2/20 0.36

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
SCHEMBL13009756 0.86 CRBN (0.42) CYP3A4GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3546927 0.81 MAPT (0.59) CRBNKMT2AALDH1A1HPGD
SCHEMBL3546922 0.81 MAPT (0.59) CRBNKMT2AALDH1A1HPGD
SCHEMBL25447007 0.79 GRIN2D (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3547590 0.79 MAPT (0.42) CYP3A4TACR1CRBNNPC1RAB9A
SCHEMBL15651184 0.79 GRIN2D (0.47) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3538626 0.76 RET (0.47) CYP3A4GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL27708997 0.76 GRIN2D (0.40) CYP3A4GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL24126004 0.76 CRBN (0.42) CYP3A4GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL21855186 0.76 HSD17B10 (0.48) CYP3A4GRIN2DGRIN3BGRIN1GRIN2A

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 CYP3A4 551/4885TACR1 2321/4885GRIN2D 542/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 CYP3A4 544/4885TACR1 2238/4885GRIN2D 542/4885

“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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