SCHEMBL17297872

SCHEMBL17297872

Cc1cc(=O)c(CNC(=O)C(C)(C)C)c2n1CCCO2

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HTR4 Q13639 9/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA7 P43166 1/20 0.32
▸ CA14 Q9ULX7 1/20 0.32
▸ PDE4A P27815 2/20 0.32
▸ PDE4B Q07343 2/20 0.32
▸ PDE4C Q08493 2/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ CNR2 P34972 2/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ MYC P01106 1/20 0.31
▸ WDR5 P61964 1/20 0.31
▸ DRD2 P14416 1/20 0.31
▸ DRD4 P21917 1/20 0.31

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
SCHEMBL17297870 0.93 KDM4E (0.34) KDM4ETP53HDAC6CA1CA2
SCHEMBL17298022 0.87 MYC (0.34) KDM4ETP53HTR4PDE4APDE4B
SCHEMBL19477677 0.86 MYC (0.32) HTR4PDE4APDE4BPDE4CPDE4D
SCHEMBL17297804 0.80 TP53 (0.35) KDM4ETP53HDAC6CA1CA2
SCHEMBL17297945 0.79 MYC (0.35) KDM4ETP53MYCWDR5
SCHEMBL19477549 0.78 MYC (0.32) MYCWDR5
SCHEMBL17297805 0.77 CNR2 (0.35) KDM4ETP53CNR2CNR1MYC
SCHEMBL20749707 0.73 EZH2 (0.41) PDE4APDE4BPDE4CPDE4D
SCHEMBL17297851 0.72 DRD4 (0.32) KDM4ETP53HDAC6CA1CA2
SCHEMBL17297854 0.71 DRD4 (0.36) HDAC6CA1CA2CA7CA14

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-20180134692-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2018-05-17 — — US disclosed
US-9701666-B2 1,4-pyridone bicyclic heteroaryl compounds Epizyme, Inc. (US) 2017-07-11 — — US disclosed
US-9701666-B2 1,4-pyridone bicyclic heteroaryl compounds Epizyme, Inc. (US) 2017-07-11 — — US disclosed
US-20150344459-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2015-12-03 — — 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 (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-20150344459-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS CYP4B1, PDXK, CYP1B1 KDM4E 821/4885TP53 350/4885HTR4 249/4885
US-20180134692-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS CYP4B1, PDXK, CYP1B1 KDM4E 821/4885TP53 350/4885HTR4 249/4885

“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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