SCHEMBL24718398

SCHEMBL24718398

O=C(NC1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)c1ccc2ccccc2c1O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.44
▸ P2RX7 Q99572 2/20 0.42
▸ P2RX1 P51575 1/20 0.42
▸ P2RX3 P56373 1/20 0.42
▸ P2RX4 Q99571 1/20 0.42
▸ DRD4 P21917 4/20 0.40
▸ SIRT2 Q8IXJ6 1/20 0.40
▸ SIRT1 Q96EB6 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ RIPK1 Q13546 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ SIGMAR1 Q99720 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
SCHEMBL24719134 0.86 NPC1 (0.47) TP53P2RX7SIRT2SIRT1KMT2A
SCHEMBL24718637 0.85 TP53 (0.49) TP53P2RX7SIRT2SIRT1KMT2A
SCHEMBL24718418 0.84 TP53 (0.53) TP53P2RX7P2RX1DRD4SIRT2
SCHEMBL24718827 0.83 TP53 (0.49) TP53P2RX7SIRT2SIRT1KMT2A
SCHEMBL24718839 0.83 TP53 (0.49) TP53P2RX7SIRT2SIRT1KMT2A
SCHEMBL24718838 0.82 TP53 (0.49) TP53P2RX7SIRT2SIRT1KMT2A
SCHEMBL24718426 0.82 SLC6A12 (0.49) TP53P2RX7SIRT2SIRT1KMT2A
SCHEMBL24718413 0.82 MAOB (0.44) TP53P2RX7SIRT2SIRT1KMT2A
SCHEMBL24718825 0.81 SCN9A (0.49) TP53P2RX7SIRT2SIRT1
SCHEMBL24718416 0.81 TP53 (0.46) TP53P2RX7DRD4SIRT2SIRT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220363633-A1 SUBSTITUTED PYRROLIDONES AND PIPERIDONES AS SMALL MOLECULE INHIBITORS OF EZH2 AND EED PROTEIN BINDING UNITED STATES GOVERNMENT 2022-11-17 — — 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 (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-20220363633-A1 SUBSTITUTED PYRROLIDONES AND PIPERIDONES AS SMALL MOLECULE INHIBITORS OF EZH2 AND EED PROTEIN BINDING EED, EZH2, ELP1 TP53 284/4885P2RX7 4354/4885P2RX1 4064/4885

“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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