SCHEMBL23965829

SCHEMBL23965829

Nc1ccc2nc(NCc3ncccn3)sc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.48
ROCK2 O75116 1/20 0.48
MAP4K4 O95819 1/20 0.48
PRKCG P05129 1/20 0.48
LYN P07948 1/20 0.48
PRKACA P17612 1/20 0.48
RPS6KB1 P23443 1/20 0.48
AKT1 P31749 1/20 0.48
FLT3 P36888 1/20 0.48
CSNK1D P48730 1/20 0.48
CLK2 P49760 1/20 0.48
IRAK1 P51617 1/20 0.48
PRKX P51817 1/20 0.48
NEK4 P51957 1/20 0.48
PRKCD Q05655 1/20 0.48
ROCK1 Q13464 1/20 0.48
DYRK1A Q13627 1/20 0.48
PKN2 Q16513 1/20 0.48
HIPK4 Q8NE63 1/20 0.48
AURKB Q96GD4 1/20 0.48

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
SCHEMBL23965785 0.87 MAOA (0.52) GAAROCK2MAP4K4PRKCGLYN
SCHEMBL23965804 0.83 RAB9A (0.56) ROCK2MAP4K4PRKCGLYNPRKACA
SCHEMBL5256491 0.83 ROCK2 (0.64) GAAROCK2MAP4K4PRKCGLYN
SCHEMBL23965805 0.80 NPC1 (0.60) GAADYRK1ASMN1; SMN2MAPTKDM4E
SCHEMBL5215893 0.79 NOS3 (0.60) GAAROCK2MAP4K4PRKCGLYN
SCHEMBL7984841 0.79 SMN1; SMN2 (0.56) GAASMN1; SMN2MAPTKDM4EGLA
SCHEMBL18384865 0.77 RIPK1 (0.55) GAASMN1; SMN2MAPTKDM4EGLA
SCHEMBL21588479 0.77 SMN1; SMN2 (0.50) GAASMN1; SMN2MAPTKDM4EGLA
SCHEMBL12297548 0.76 SMN1; SMN2 (0.59) GAASMN1; SMN2MAPTKDM4EGLA
SCHEMBL5305295 0.75 NPC1 (0.70) GAAROCK2MAP4K4PRKCGLYN

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-11161830-B2 4-pyridone compound or salt thereof, and pharmaceutical composition and formulation including same FUJIFILM CORPORATION (JP) 2021-11-02 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-11161830-B2 4-pyridone compound or salt thereof, and pharmaceutical composition and formulation including same HAVCR2, HBS1L, PHKB GAA 3108/4885ROCK2 3716/4885MAP4K4 1009/4885

“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.