SCHEMBL24718842

SCHEMBL24718842

O=C(NC[C@H]1CC(=O)N(Cc2cccc(F)c2)C1)c1cc(C(F)(F)F)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.47
▸ KMT2A Q03164 5/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KCNH2 Q12809 1/20 0.41
▸ CACNA1I Q9P0X4 1/20 0.41
▸ UBE2M P61081 1/20 0.41
▸ DCUN1D1 Q96GG9 1/20 0.41
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ CCR2 P41597 1/20 0.39

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
SCHEMBL24718258 0.94 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1KCNH2CACNA1I
SCHEMBL24718672 0.94 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1KCNH2CACNA1I
SCHEMBL24718263 0.94 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1KCNH2CACNA1I
SCHEMBL24718261 0.83 P2RX7 (0.41) ALDH1A1NPC1CCR2
SCHEMBL24718257 0.79 TEAD1 (0.52) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL24718648 0.79 TEAD1 (0.52) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL24718303 0.79 TEAD1 (0.52) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL24718666 0.73 P2RX7 (0.49) ALDH1A1KMT2AMEN1KCNH2CACNA1I
SCHEMBL24718661 0.73 P2RX7 (0.49) ALDH1A1KMT2AMEN1KCNH2CACNA1I
SCHEMBL24718841 0.73 P2RX7 (0.49) ALDH1A1KMT2AMEN1KCNH2CACNA1I

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 ALDH1A1 1312/4885KMT2A 180/4885MEN1 3534/4885

“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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