SCHEMBL19107369

SCHEMBL19107369

CC(C)(C)OC(=O)N1CCC2(CC1)CN(C(=O)c1ccccc1Cl)CC1(CC1)O2

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.49
▸ EPHX2 P34913 2/20 0.45
▸ SCD5 Q86SK9 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ STS P08842 1/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALOX15 P16050 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ ATM Q13315 1/20 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
SCHEMBL19107358 0.88 POLB (0.45) POLBSCD5ALDH1A1IDO1MAPT
SCHEMBL17328258 0.87 PARP1 (0.47) POLBEPHX2SCD5THRBIDO1
SCHEMBL19120395 0.86 HTT (0.48) POLBSCD5KMT2AMEN1ALDH1A1
SCHEMBL19107368 0.85 POLB (0.45) POLBEPHX2SCD5KMT2AMEN1
SCHEMBL19120304 0.84 GPR119 (0.44) POLBSCD5ALDH1A1IDO1ALOX15
SCHEMBL19107356 0.83 HPGD (0.46) POLBEPHX2SCD5THRBIDO1
SCHEMBL18785466 0.80 MEN1 (0.49) SCD5KMT2AMEN1ALOX15TSHR
SCHEMBL19107359 0.80 PARP1 (0.45) POLBEPHX2SCD5THRBIDO1
SCHEMBL17328253 0.80 SCD5 (0.48) POLBEPHX2SCD5ALDH1A1TSHR
SCHEMBL17328248 0.79 EPHX2 (0.45) EPHX2SCD5

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
EP-3149005-B1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE LABOR DR (ES) 2018-04-18 — — EP disclosed
US-20170197984-A1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2017-07-13 — — US disclosed
US-20170197984-A1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2017-07-13 — — 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 (1 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-20170197984-A1 AMIDE DERIVATIVES OF 1-OXA-4,9-DIAZASPIRO UNDECANE COMPOUNDS HAVING MULTIMODAL ACTIVITY AGAINST PAIN OPRD1, SIGMAR1, OPRM1 POLB 1747/4885EPHX2 2094/4885SCD5 2111/4885

“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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