SCHEMBL23483863

SCHEMBL23483863

COC(=O)c1cc2c(n1S(=O)(=O)c1ccc(C)cc1)C(=O)C(=O)c1[nH]cc(C(=O)OCc3ccccc3)c1-2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 1.00
▸ OPRD1 P41143 1/20 1.00
▸ NOD2 Q9HC29 1/20 0.40
▸ NOD1 Q9Y239 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ L3MBTL1 Q9Y468 4/20 0.39
▸ LMNA P02545 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ PSEN1 P49768 1/20 0.38
▸ PSEN2 P49810 1/20 0.38
▸ APH1B Q8WW43 1/20 0.38
▸ NCSTN Q92542 1/20 0.38
▸ APH1A Q96BI3 1/20 0.38
▸ PSENEN Q9NZ42 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ FOLH1 Q04609 1/20 0.37
▸ CA1 P00915 3/20 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
SCHEMBL15413322 0.97 OPRM1 (0.94) OPRM1OPRD1NOD2NOD1MAPT
SCHEMBL20830347 0.93 OPRM1 (0.86) OPRM1OPRD1NOD2NOD1MAPT
SCHEMBL20816038 0.92 OPRM1 (0.85) OPRM1OPRD1NOD2NOD1MAPT
SCHEMBL20816042 0.79 OPRM1 (0.65) OPRM1OPRD1NOD2NOD1MAPT
SCHEMBL15413498 0.78 OPRM1 (0.62) OPRM1OPRD1NOD2NOD1ALDH1A1
SCHEMBL25015538 0.72 OPRM1 (0.57) OPRM1OPRD1MAPTL3MBTL1LMNA
SCHEMBL20830348 0.66 OPRM1 (0.49) OPRM1OPRD1MAPTL3MBTL1LMNA
SCHEMBL20816040 0.65 OPRM1 (0.48) OPRM1OPRD1NOD2NOD1MAPT
SCHEMBL2775811 0.65 OPRM1 (0.46) OPRM1OPRD1NOD2NOD1MAPT
SCHEMBL20816043 0.64 OPRM1 (0.47) OPRM1OPRD1MAPTL3MBTL1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230044407-A1 TARGETING MB2 OF THE MYC ONCOGENE AND ITS INTERACTION WITH TRRAP IN CANCER THE TRUSTEES OF DARTMOUTH COLLEGE 2023-02-09 — — US disclosed
WO-2021113347-A1 TARGETING MB2 OF THE MYC ONCOGENE AND ITS INTERACTION WITH TRRAP IN CANCER THE TRUSTEES OF DARTMOUTH COLLEGE (US) 2021-06-10 — — 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 (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-20230044407-A1 TARGETING MB2 OF THE MYC ONCOGENE AND ITS INTERACTION WITH TRRAP IN CANCER MYCBP, MYC, TERF2IP OPRM1 3570/4885OPRD1 3669/4885NOD2 4860/4885

“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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