SCHEMBL24062023

SCHEMBL24062023

COC(=O)CC1=C(C)/C(=C/c2cc(OC)c(O)c(OC)c2)c2ccc(F)cc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 13/20 0.57
▸ RXRA P19793 5/20 0.56
▸ CYP1A2 P05177 3/20 0.51
▸ MAPT P10636 3/20 0.51
▸ MAPK1 P28482 3/20 0.51
▸ PTGS2 P35354 2/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ EGFR P00533 1/20 0.51
▸ ADORA3 P0DMS8 1/20 0.51
▸ DRD1 P21728 1/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ PSEN1 P49768 1/20 0.51
▸ PSEN2 P49810 1/20 0.51
▸ APH1B Q8WW43 1/20 0.51
▸ NCSTN Q92542 1/20 0.51
▸ APH1A Q96BI3 1/20 0.51
▸ PSENEN Q9NZ42 1/20 0.51
▸ CYSLTR1 Q9Y271 1/20 0.51
▸ PTGDR2 Q9Y5Y4 1/20 0.51

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
SCHEMBL8155275 0.91 PPARG (0.57) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17819199 0.90 PPARG (0.71) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17819202 0.90 PPARG (0.71) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17848221 0.87 CA12 (0.56) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17848264 0.87 CA12 (0.56) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17848206 0.85 CA12 (0.54) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17821316 0.85 PPARG (0.57) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17821315 0.85 PPARG (0.57) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17848266 0.85 CA12 (0.54) PPARGRXRACYP1A2MAPTMAPK1
SCHEMBL17821314 0.84 PPARG (0.56) PPARGRXRACYP1A2MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11680073-B2 Anticancer indenes, indanes, azaindenes, azaindanes, pharmaceutical compositions and uses ADT PHARMACEUTICALS, LLC (US) 2023-06-20 — — US disclosed
US-11680073-B2 Anticancer indenes, indanes, azaindenes, azaindanes, pharmaceutical compositions and uses ADT PHARMACEUTICALS, LLC (US) 2023-06-20 — — US disclosed
US-20220048931-A1 ANTICANCER INDENES, INDANES, AZAINDENES, AZAINDANES, PHARMACEUTICAL COMPOSITIONS AND USES ADT PHARMACEUTICALS, LLC (US) 2022-02-17 — — US disclosed
US-11186596-B2 Anticancer indenes, indanes, azaindenes, azaindanes, pharmaceutical compositions and uses ADT PHARMACEUTICALS, LLC (US) 2021-11-30 — — 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 (3 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-20220048931-A1 ANTICANCER INDENES, INDANES, AZAINDENES, AZAINDANES, PHARMACEUTICAL COMPOSITIONS AND USES CDKN1A, CCNA1, CCNA2 PPARG 3173/4885RXRA 725/4885CYP1A2 10/4885
US-11186596-B2 Anticancer indenes, indanes, azaindenes, azaindanes, pharmaceutical compositions and uses CCNA2, CDKN1A, CCNA1 PPARG 3107/4885RXRA 724/4885CYP1A2 6/4885
US-11680073-B2 Anticancer indenes, indanes, azaindenes, azaindanes, pharmaceutical compositions and uses CDKN1A, CCNA1, CCNA2 PPARG 3173/4885RXRA 725/4885CYP1A2 10/4885

“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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