SCHEMBL24423552

SCHEMBL24423552

COc1cc(-c2cc(C(=O)N3CCC(C(=O)NCc4cccc(F)c4F)CC3)n[nH]2)c(Cl)cn1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMO Q99835 2/20 0.42
▸ EPHX2 P34913 2/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ P2RX7 Q99572 3/20 0.38
▸ CA12 O43570 2/20 0.38
▸ CA1 P00915 2/20 0.38
▸ CA2 P00918 2/20 0.38
▸ CA9 Q16790 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP2D6 P10635 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL29583439 1.00 SMO (0.42) SMOEPHX2KDM4EALDH1A1MEN1
SCHEMBL24423840 0.96 SMO (0.43) SMOEPHX2KDM4EALDH1A1MEN1
SCHEMBL29583211 0.96 SMO (0.43) SMOEPHX2KDM4EALDH1A1MEN1
SCHEMBL24424624 0.90 EPHX2 (0.39) SMOEPHX2KDM4EALDH1A1MEN1
SCHEMBL24423942 0.90 EPHX2 (0.41) SMOEPHX2MEN1KMT2AP2RX7
SCHEMBL29584084 0.90 EPHX2 (0.41) SMOEPHX2MEN1KMT2AP2RX7
SCHEMBL24424602 0.88 SMO (0.42) SMOEPHX2KDM4EALDH1A1MEN1
SCHEMBL24424000 0.88 EPHX2 (0.44) SMOEPHX2MEN1KMT2ACA12
SCHEMBL29243659 0.88 EPHX2 (0.47) SMOEPHX2
SCHEMBL30630709 0.88 EPHX2 (0.47) SMOEPHX2

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
CN-116635380-A PPARgamma modulators and methods of use 卫材R&D管理有限公司 2023-08-22 — — CN claimed
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

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 SMO 1469/4885EPHX2 3345/4885KDM4E 3945/4885

“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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