SCHEMBL29645765

SCHEMBL29645765

COc1ccc2nc(Nc3ccccnc3=O)n3nc(-c4ccccc4F)nc3c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
THRB P10828 2/20 0.39
MAPK9 P45984 2/20 0.38
PTPN11 Q06124 1/20 0.38
ADORA3 P0DMS8 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA2B P29275 1/20 0.38
ADORA1 P30542 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MDM2 Q00987 1/20 0.38
TP53 P04637 1/20 0.37
HCRTR1 O43613 1/20 0.37
PABPC1 P11940 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
C1R P00736 1/20 0.37
MET P08581 1/20 0.37
MAPK8 P45983 1/20 0.36
MAPK10 P53779 1/20 0.36

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
SCHEMBL29645893 0.90 MAPT (0.45) MAPTTHRBMAPK9ADORA3RXFP1
SCHEMBL29645913 0.88 CCNC (0.39) MAPT
SCHEMBL29645577 0.88 MAPT (0.45) MAPTTHRBADORA3RXFP1ADORA1
SCHEMBL29645943 0.87 MAPT (0.50) MAPTTHRBADORA3RXFP1ALDH1A1
SCHEMBL29645527 0.86 MAPT (0.41) MAPTTP53
SCHEMBL29646093 0.85 MAT2A (0.38)
SCHEMBL29645988 0.84 MAPT (0.47) MAPTTHRBADORA3RXFP1ADORA2A
SCHEMBL29645672 0.83 MAPT (0.46) MAPTTHRBADORA3RXFP1TP53
SCHEMBL29646058 0.83 MAPT (0.47) MAPTTHRBRXFP1TP53HPGD
SCHEMBL29646060 0.82 TP53 (0.47) MAPTTHRBADORA3RXFP1ALDH1A1

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
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