SCHEMBL29585591

SCHEMBL29585591

COc1cc(-c2cc(C(=O)N3[C@@H]4CC[C@H]3CC(C(=O)OCc3ccccc3)C4)n[nH]2)c(Cl)cn1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ STS P08842 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.37
▸ CYP4F2 P78329 1/20 0.36
▸ CYP4A11 Q02928 1/20 0.36
▸ PIK3CA P42336 2/20 0.35
▸ MTOR P42345 2/20 0.35
▸ FFAR2 O15552 2/20 0.34
▸ NAMPT P43490 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33

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
SCHEMBL30630698 0.91 CYP4F2 (0.36) STSCYP4F2CYP4A11PIK3CAMTOR
SCHEMBL29585274 0.91 CYP4F2 (0.36) STSCYP4F2CYP4A11PIK3CAMTOR
SCHEMBL25090842 0.91 CYP4F2 (0.36) STSCYP4F2CYP4A11PIK3CAMTOR
SCHEMBL29585588 0.87 CHRM4 (0.34) FFAR2
SCHEMBL24423446 0.87 CHRM4 (0.34) FFAR2
SCHEMBL30630805 0.87 CHRM4 (0.34) FFAR2
SCHEMBL24423713 0.86 CYP4F2 (0.36) CYP4F2CYP4A11FFAR2
SCHEMBL29584640 0.86 CYP4F2 (0.36) CYP4F2CYP4A11FFAR2
SCHEMBL25090882 0.82 POLB (0.43) —
SCHEMBL25090883 0.82 POLB (0.43) —

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-12606541-B2 PPARg modulators and methods of use EISAI R&D MANAGEMENT CO., LTD. (JP) 2026-04-21 — — US disclosed
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 — — EP disclosed
US-20230062861-A1 PPARg MODULATORS AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-03-02 — — US disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — 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-20230062861-A1 PPARg MODULATORS AND METHODS OF USE PPARG, PPARA, PPARD STS 2646/4885SLC6A3 4114/4885CYP4F2 290/4885
US-12606541-B2 PPARg modulators and methods of use PPARG, PPARA, PPARD STS 1962/4885SLC6A3 3196/4885CYP4F2 523/4885

“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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