SCHEMBL22927263

SCHEMBL22927263

Cc1sc2c3ccccc3n(C(C)C)c2c1N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
POLB P06746 3/20 0.35
HTT P42858 1/20 0.35
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCH P24723 1/20 0.34
PRKCI P41743 1/20 0.34
PRKCE Q02156 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
SCHEMBL25125063 0.84 MAPT (0.37) MAPTTSHRMAPK1CASP1CASP7
SCHEMBL19233787 0.80 ALKBH5 (0.46) MAPTTSHRMEN1KMT2AHTT
SCHEMBL25784407 0.74 GRM6 (0.38) MAPTTSHRMAPK1CASP1CASP7
SCHEMBL23072106 0.74 BCHE (0.39) MAPTTSHRMAPK1CASP1CASP7
SCHEMBL20209690 0.72 BCHE (0.43) MAPTTSHRMAPK1CASP1CASP7
SCHEMBL25702390 0.70 MAPT (0.41) MAPTTSHRMAPK1CASP1CASP7
SCHEMBL20401915 0.70
SCHEMBL23072091 0.69 BCHE (0.43) MAPTTSHRMAPK1CASP1CASP7
SCHEMBL25953765 0.69 BCHE (0.40) MAPTTSHRMAPK1CASP1CASP7
SCHEMBL150044 0.68 BCHE (0.59) MAPTTSHRMAPK1CASP1CASP7

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-20210024559-A1 TETRADENTATE AND OCTAHEDRAL METAL COMPLEXES CONTAINING NAPHTHYRIDINOCARBAZOLE AND ITS ANALOGUES UNIV ARIZONA STATE (US) 2021-01-28 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-20210024559-A1 TETRADENTATE AND OCTAHEDRAL METAL COMPLEXES CONTAINING NAPHTHYRIDINOCARBAZOLE AND ITS ANALOGUES PAICS, DNTT, PNPO MAPT 462/4885TSHR 2799/4885MAPK1 4717/4885

“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.