SCHEMBL24718429

SCHEMBL24718429

O=C(NC1CC(=O)N(Cc2ccccc2C(F)(F)F)C1)c1ccc2cc[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 1/20 0.46
▸ EPHX2 P34913 11/20 0.44
▸ PPARG P37231 7/20 0.44
▸ CHRNA7 P36544 1/20 0.43
▸ F10 P00742 1/20 0.42
▸ MAPK11 Q15759 1/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ GHSR Q92847 1/20 0.41
▸ ACSS2 Q9NR19 1/20 0.41
▸ TP53 P04637 1/20 0.40

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
SCHEMBL24718280 0.83 EPHX2 (0.53) EPHX2ACSS2TP53
SCHEMBL24719111 0.83 EPHX2 (0.47) EPHX2PPARGACSS2TP53
SCHEMBL24718421 0.82 TP53 (0.46) TP53
SCHEMBL24719126 0.82 EPHX2 (0.42) EPHX2PPARGACSS2TP53
SCHEMBL24718389 0.81 TP53 (0.46) ACSS2TP53
SCHEMBL24719134 0.78 NPC1 (0.47) TP53
SCHEMBL24718622 0.78 EPHX2 (0.46) EPHX2TP53
SCHEMBL24718839 0.77 TP53 (0.49) EPHX2TP53
SCHEMBL24718637 0.77 TP53 (0.49) TP53
SCHEMBL24718827 0.77 TP53 (0.49) EPHX2TP53

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 SMYD3 485/4885EPHX2 1431/4885PPARG 589/4885

“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.

Send feedback