SCHEMBL17848323

SCHEMBL17848323

COc1cc(/C=C2/C(C)=C(CC(=O)Nc3cccc(Br)c3)c3cc(F)ccc32)cc(OC)c1O

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 12/20 0.57
▸ RXRA P19793 4/20 0.48
▸ CA12 O43570 1/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA4 P22748 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ PSMD14 O00487 1/20 0.44
▸ KMT2A Q03164 1/20 0.44

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
SCHEMBL17848222 1.00 PPARG (0.57) PPARGRXRACA12CA1CA2
SCHEMBL17848187 0.91 PPARG (0.62) PPARGRXRACA12CA1CA2
SCHEMBL17859159 0.91 PPARG (0.60) PPARGRXRACA12CA1CA2
SCHEMBL17848299 0.91 PPARG (0.56) PPARGRXRACA12CA1CA2
SCHEMBL17848189 0.91 PPARG (0.62) PPARGRXRACA12CA1CA2
SCHEMBL17848300 0.91 PPARG (0.56) PPARGRXRACA12CA1CA2
SCHEMBL17848278 0.90 CA12 (0.53) PPARGRXRACA12CA1CA2
SCHEMBL17848275 0.90 CA12 (0.53) PPARGRXRACA12CA1CA2
SCHEMBL17821315 0.90 PPARG (0.57) PPARGRXRACA12CA1CA2
SCHEMBL17821316 0.90 PPARG (0.57) PPARGRXRACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170342021-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, LLC 2017-11-30 — — US claimed
EP-3233070-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT Pharmaceuticals, Inc. (US) 2017-10-25 — — EP claimed
WO-2016099452-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, INC. (US) 2016-06-23 — — WO claimed
US-20170342021-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, LLC 2017-11-30 — — US disclosed
US-20170342021-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, LLC 2017-11-30 — — US disclosed
US-20170342021-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, LLC 2017-11-30 — — US disclosed
EP-3233070-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT Pharmaceuticals, Inc. (US) 2017-10-25 — — EP disclosed
WO-2016099452-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, INC. (US) 2016-06-23 — — WO disclosed
WO-2016099452-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES ADT PHARMACEUTICALS, INC. (US) 2016-06-23 — — 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-20170342021-A1 RAS-INHIBITING INDENYL ACETAMIDE COMPOUNDS, COMPOSITIONS, AND USES KRAS, NRAS, HRAS PPARG 2635/4885RXRA 341/4885CA12 3756/4885

“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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