SCHEMBL25890257

SCHEMBL25890257

CN1C(=O)C(C)(C)c2ncccc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
HCRTR1 O43613 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
CACNA1B Q00975 1/20 0.38
APBA1 Q02410 1/20 0.38
GAA P10253 2/20 0.37
NISCH Q9Y2I1 1/20 0.36
MYC P01106 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
PRKDC P78527 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 1/20 0.34

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
SCHEMBL25890245 0.83 GAA (0.39) LMNAKDM4EMAPTHCRTR1ADORA3
SCHEMBL25891484 0.80 LMNA (0.36) LMNAKDM4EMAPTHCRTR1ADORA3
SCHEMBL30276209 0.79 PRKDC (0.43) LMNAKDM4EMAPTHCRTR1ADORA3
SCHEMBL9840829 0.79 GAA (0.35) LMNAKDM4EMAPTADORA3ADORA2A
SCHEMBL30276171 0.78 PRKDC (0.43) LMNAKDM4EMAPTHCRTR1ADORA3
SCHEMBL30276207 0.78 PRKDC (0.43) LMNAKDM4EMAPTHCRTR1ADORA3
SCHEMBL25891443 0.78 ALDH1A1 (0.43) ALDH1A1HPGDCACNA1BAPBA1MEN1
SCHEMBL30276155 0.77 PRKDC (0.42) LMNAKDM4EMAPTHCRTR1ADORA3
SCHEMBL9591238 0.74 LMNA (0.50) LMNAKDM4EMAPTHCRTR1ALDH1A1
SCHEMBL30485377 0.73 PRKDC (0.38) LMNAKDM4EMAPTHCRTR1ADORA3

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-20230234938-A1 NOVEL COMPOUNDS USEFUL AS POLY(ADP-RIBOSE) POLYMERASE (PARP) INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-07-27 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-20230234938-A1 NOVEL COMPOUNDS USEFUL AS POLY(ADP-RIBOSE) POLYMERASE (PARP) INHIBITORS PARP1, PARP2, PARP3 LMNA 732/4885KDM4E 2941/4885MAPT 4169/4885

“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.