SCHEMBL23965796

SCHEMBL23965796

Cc1ccc2nc(NCc3ccccn3)sc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.58
RAB9A P51151 6/20 0.58
MAPT P10636 2/20 0.58
HTT P42858 2/20 0.58
OPRK1 P41145 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.52
DYRK1A Q13627 2/20 0.48
LMNA P02545 2/20 0.48
CSNK1D P48730 2/20 0.47
ROCK2 O75116 1/20 0.47
MAP4K4 O95819 1/20 0.47
PRKCG P05129 1/20 0.47
LYN P07948 1/20 0.47
PRKACA P17612 1/20 0.47
RPS6KB1 P23443 1/20 0.47
AKT1 P31749 1/20 0.47
FLT3 P36888 1/20 0.47
CLK2 P49760 1/20 0.47
IRAK1 P51617 1/20 0.47
PRKX P51817 1/20 0.47

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
SCHEMBL23965804 0.87 RAB9A (0.56) NPC1RAB9AMAPTHTTOPRK1
SCHEMBL31738384 0.85 CYP1A2 (0.54) NPC1RAB9AMAPTHTTSMN1; SMN2
SCHEMBL31738383 0.85 CYP1A2 (0.54) NPC1RAB9AMAPTHTTSMN1; SMN2
SCHEMBL23965785 0.85 MAOA (0.52) NPC1RAB9AMAPTHTTOPRK1
SCHEMBL23965797 0.84 NPC1 (0.56) NPC1RAB9AMAPTHTTSMN1; SMN2
SCHEMBL13993855 0.81 CSNK1D (0.64) NPC1RAB9AMAPTHTTOPRK1
SCHEMBL9381221 0.77 NOS3 (0.47) NPC1RAB9AMAPTHTTOPRK1
SCHEMBL8019525 0.76 NPC1 (0.59) NPC1RAB9AMAPTHTTOPRK1
SCHEMBL9375356 0.75 RAB9A (0.47) NPC1RAB9AMAPTHTTOPRK1
SCHEMBL14858450 0.74 RAB9A (0.48) NPC1RAB9AMAPTHTTSMN1; SMN2

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 NPC1 1739/4885RAB9A 2878/4885MAPT 2580/4885

“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.