SCHEMBL25994598

SCHEMBL25994598

Bc1cc(N)cc2c1CNC2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.40
▸ CLK4 Q9HAZ1 5/20 0.37
▸ ROCK1 Q13464 4/20 0.37
▸ CDK5 Q00535 2/20 0.37
▸ DYRK1A Q13627 2/20 0.37
▸ DYRK1B Q9Y463 2/20 0.37
▸ PIM1 P11309 2/20 0.37
▸ CSNK1A1 P48729 1/20 0.37
▸ LRRK2 Q5S007 1/20 0.37
▸ PIK3CD O00329 4/20 0.35
▸ PIK3CB P42338 4/20 0.35
▸ PIK3CA P42336 3/20 0.35
▸ CA12 O43570 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ KDR P35968 5/20 0.33
▸ LTK P29376 1/20 0.33
▸ MST1R Q04912 1/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ PARP1 P09874 1/20 0.32

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
SCHEMBL8169835 0.83 GRM2 (0.44) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL24147834 0.78 CLK4 (0.53) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL8170641 0.78 CLK4 (0.37) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL3532428 0.70 GRM2 (0.46) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL24148319 0.69 CDK5 (0.61) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL24148409 0.68 CDK5 (0.38) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL18863211 0.67 GRM2 (0.50) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL29222635 0.67 CLK4 (0.44) GRM2CLK4ROCK1CDK5DYRK1A
SCHEMBL1233219 0.65 NTRK2 (0.56) CLK4DYRK1BCA12CA9KDR
SCHEMBL29508433 0.65 NTRK2 (0.56) CLK4DYRK1BCA12CA9KDR

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-11731953-B2 Methods and compounds for restoring mutant p53 function PMV PHARMACEUTICALS, INC. (US) 2023-08-22 — — 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-11731953-B2 Methods and compounds for restoring mutant p53 function TP53, TP53BP1, HRAS GRM2 3669/4885CLK4 2153/4885ROCK1 2261/4885

“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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