SCHEMBL18200168

SCHEMBL18200168

COc1cc(CO)c(OC(=O)OC(C)(C)C)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 5/20 0.48
▸ MTNR1B P49286 5/20 0.48
▸ CYP3A4 P08684 2/20 0.44
▸ PDE4A P27815 1/20 0.43
▸ PDE4B Q07343 1/20 0.43
▸ PDE4C Q08493 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ ELANE P08246 1/20 0.38
▸ STING1 Q86WV6 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ HTR2A P28223 2/20 0.37
▸ TNFSF11 O14788 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 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
SCHEMBL18188997 0.87 PDE4A (0.52) CYP3A4PDE4APDE4BPDE4CPDE4D
SCHEMBL16072689 0.81 ELANE (0.45) MTNR1AMTNR1BELANEBRD4ALDH1A1
SCHEMBL16072690 0.81 ALDH1A1 (0.47) MTNR1AMTNR1BELANEHTR2AALDH1A1
SCHEMBL18188999 0.78 CYP3A4 (0.50) CYP3A4PDE4APDE4BPDE4CPDE4D
SCHEMBL16785675 0.78 TNFSF11 (0.42) MTNR1AMTNR1BCYP3A4ELANESTING1
SCHEMBL16785673 0.78 TNFSF11 (0.42) MTNR1AMTNR1BCYP3A4ELANESTING1
SCHEMBL13337963 0.77 ELANE (0.51) MTNR1AMTNR1BELANEKDM4EBRD4
SCHEMBL18200159 0.76 MTNR1A (0.42) MTNR1AMTNR1BELANEKDM4EBRD4
SCHEMBL95746 0.75 PDE4A (0.64) CYP3A4PDE4APDE4BPDE4CPDE4D
SCHEMBL16072691 0.75 MTNR1A (0.41) MTNR1AMTNR1BELANEALDH1A1GAA

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
EP-3288933-B1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF MUSC FOUND FOR RES DEV (US) 2021-10-06 — — EP disclosed
US-10370328-B2 Oxindole compounds and pharmaceutical compositions thereof MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2019-08-06 — — US disclosed
US-20180134659-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2018-05-17 — — US disclosed
US-20180134659-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2018-05-17 — — US disclosed
WO-2016176420-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2016-11-03 — — 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-10370328-B2 Oxindole compounds and pharmaceutical compositions thereof PARK7, OPRK1, COMT MTNR1A 66/4885MTNR1B 44/4885CYP3A4 245/4885
US-20180134659-A1 OXINDOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF PARK7, OPRK1, COMT MTNR1A 66/4885MTNR1B 44/4885CYP3A4 245/4885

“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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