SCHEMBL24718399

SCHEMBL24718399

O=C1C[C@@H](CN2C(=O)c3ccccc3C2=O)CN1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ KMT2A Q03164 1/20 0.46
▸ DRD2 P14416 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ KCNN4 O15554 2/20 0.42
▸ TEAD1 P28347 1/20 0.42
▸ ROCK2 O75116 1/20 0.42
▸ ROCK1 Q13464 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ HTR6 P50406 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41

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
SCHEMBL24718625 1.00 CA12 (0.47) CA12CA9KMT2ADRD2DRD3
SCHEMBL9456354 0.84 HPGD (0.54) KMT2A
SCHEMBL24718387 0.82 CA12 (0.48) CA12CA9KMT2ADRD2DRD3
SCHEMBL24718623 0.82 KMT2A (0.51) KMT2ADRD2DRD3KCNH2POLB
SCHEMBL10912263 0.82 KMT2A (0.53) KMT2ADRD2DRD3KCNH2POLB
SCHEMBL9456619 0.82 KMT2A (0.51) KMT2ADRD2DRD3KCNH2POLB
SCHEMBL24718264 0.82 KMT2A (0.51) KMT2ADRD2DRD3KCNH2POLB
SCHEMBL24718268 0.79 CA12 (0.44) CA12CA9KMT2AKCNH2ATM
SCHEMBL24719106 0.78 KMT2A (0.48) KMT2ADRD2DRD3KCNH2POLB
SCHEMBL18669003 0.78 CA9 (0.61) CA12CA9KMT2AATM

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 CA12 4697/4885CA9 4598/4885KMT2A 180/4885

“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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