SCHEMBL24423623

SCHEMBL24423623

COc1cc(-c2cc(C(=O)N3CCC(C(=O)NCc4ncc(C(F)(F)F)cn4)CC3)n[nH]2)c(Cl)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKAA2 P54646 4/20 0.40
▸ PRKAB2 O43741 1/20 0.40
▸ PRKAG1 P54619 1/20 0.40
▸ PRKAA1 Q13131 1/20 0.40
▸ PRKAG3 Q9UGI9 1/20 0.40
▸ PRKAG2 Q9UGJ0 1/20 0.40
▸ PRKAB1 Q9Y478 1/20 0.40
▸ EPHX2 P34913 6/20 0.38
▸ KDM5A P29375 3/20 0.37
▸ PIK3CA P42336 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMO Q99835 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ BIRC5 O15392 1/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ UBE2M P61081 1/20 0.34
▸ DCUN1D1 Q96GG9 1/20 0.34

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
SCHEMBL24423551 0.92 KDM5A (0.39) EPHX2KDM5AALDH1A1KMT2ASMO
SCHEMBL24424642 0.91 PRKAA2 (0.39) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL24424600 0.91 PRKAA2 (0.42) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL30629615 0.91 PRKAA2 (0.42) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL29585281 0.90 SMO (0.42) EPHX2KDM5AALDH1A1KMT2ASMO
SCHEMBL29243462 0.90 SMO (0.42) EPHX2KDM5AALDH1A1KMT2ASMO
SCHEMBL29243737 0.90 KDM5A (0.39) KDM5AALDH1A1KMT2ASMO
SCHEMBL29585180 0.90 KDM5A (0.39) KDM5AALDH1A1KMT2ASMO
SCHEMBL25090829 0.89 EPHX2 (0.43) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3
SCHEMBL29586453 0.88 PRKAA2 (0.40) PRKAA2PRKAB2PRKAG1PRKAA1PRKAG3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 — — EP claimed
CN-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 — — CN claimed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — WO claimed
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 — — EP disclosed
CN-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 — — CN 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
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 (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-20230062861-A1 PPARg MODULATORS AND METHODS OF USE PPARG, PPARA, PPARD PRKAA2 126/4885PRKAB2 51/4885PRKAG1 39/4885

“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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