SCHEMBL29645864

SCHEMBL29645864

O=c1nccccc1Nc1nc2c(Cl)cccc2c2nc(-c3ccncc3)nn12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
POLB P06746 3/20 0.38
THRB P10828 1/20 0.38
RAD52 P43351 1/20 0.38
SMARCA2 P51531 1/20 0.38
KMT2A Q03164 1/20 0.38
UHRF1 Q96T88 1/20 0.38
CDC7 O00311 1/20 0.37
MAPK13 O15264 1/20 0.37
DAPK3 O43293 1/20 0.37
ROCK2 O75116 1/20 0.37
MAP4K4 O95819 1/20 0.37
PIM1 P11309 1/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
NEK4 P51957 1/20 0.37
MAPK12 P53778 1/20 0.37
CSNK2A1 P68400 1/20 0.37
ROCK1 Q13464 1/20 0.37
DYRK1A Q13627 1/20 0.37

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
SCHEMBL29645933 0.90 TP53 (0.41) MAPTTHRBKMT2A
SCHEMBL29645930 0.88 POLB (0.38) MAPTPOLBTHRBRAD52SMARCA2
SCHEMBL29645443 0.88 LMNA (0.40) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29645929 0.88 KDM4E (0.47) MAPTPOLBTHRBKMT2AALDH1A1
SCHEMBL29645778 0.87 LMNA (0.38) MAPTTHRBKMT2A
SCHEMBL29645601 0.84 MAPT (0.35) MAPTTHRBKMT2A
SCHEMBL29645755 0.83 MAPT (0.40) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL31150081 0.82 MAPT (0.40) MAPTTHRB
SCHEMBL29645906 0.82 ADORA3 (0.36) MAPT
SCHEMBL29645618 0.80 ADORA3 (0.40) MAPTGABRPGABRDGABRA1GABRB1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN claimed
CN-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN disclosed