SCHEMBL24718308

SCHEMBL24718308

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

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 3/20 0.49
▸ DRD4 P21917 3/20 0.48
▸ SIGMAR1 Q99720 2/20 0.46
▸ KMT2A Q03164 2/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ ATM Q13315 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ CACNA1I Q9P0X4 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ MEN1 O00255 1/20 0.42

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
SCHEMBL24718420 1.00 SRC (0.49) SRCDRD4SIGMAR1KMT2AALDH1A1
SCHEMBL24718296 1.00 SRC (0.49) SRCDRD4SIGMAR1KMT2AALDH1A1
SCHEMBL24718259 0.85 SRC (0.43) SRCSIGMAR1KMT2AALDH1A1KDM4E
SCHEMBL24718257 0.80 TEAD1 (0.52) DRD4SIGMAR1KMT2AALDH1A1ATM
SCHEMBL24718648 0.80 TEAD1 (0.52) DRD4SIGMAR1KMT2AALDH1A1ATM
SCHEMBL24718303 0.80 TEAD1 (0.52) DRD4SIGMAR1KMT2AALDH1A1ATM
SCHEMBL1065804 0.79 SCN9A (0.50) SRCDRD4SIGMAR1KMT2AALDH1A1
SCHEMBL1065805 0.79 SCN9A (0.50) SRCDRD4SIGMAR1KMT2AALDH1A1
SCHEMBL24718262 0.79 ALDH1A1 (0.43) DRD4SIGMAR1KMT2AALDH1A1ATM
SCHEMBL24719128 0.77 SRC (0.43) SRCSIGMAR1KMT2AALDH1A1KDM4E

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 SRC 1194/4885DRD4 1560/4885SIGMAR1 4065/4885

“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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