SCHEMBL29645720

SCHEMBL29645720

CCOc1ccc(-c2nc3c4ccccc4nc(Nc4ccccnc4=O)n3n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.57
MAPT P10636 7/20 0.50
THRB P10828 1/20 0.50
POLB P06746 3/20 0.49
KMT2A Q03164 2/20 0.45
RAD52 P43351 2/20 0.45
SMARCA2 P51531 1/20 0.45
UHRF1 Q96T88 1/20 0.45
ALPL P05186 2/20 0.44
GAA P10253 2/20 0.44
LMNA P02545 1/20 0.44
ALPI P09923 1/20 0.44
ALPG P10696 1/20 0.44
TP53 P04637 4/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HCRTR1 O43613 1/20 0.43
HTT P42858 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43

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
SCHEMBL29645487 0.90 MAPT (0.59) ADORA3MAPTTHRBPOLBALPL
SCHEMBL29645760 0.88 MAPT (0.56) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29645441 0.88 MAPT (0.47) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29645510 0.87 MAPT (0.44) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29645700 0.86 MAPT (0.45) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29646028 0.86 MAPT (0.45) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29645888 0.85 MAPT (0.55) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29645503 0.85 ADORA3 (0.49) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29645834 0.85 ADORA3 (0.49) ADORA3MAPTTHRBPOLBKMT2A
SCHEMBL29645516 0.85 MAPT (0.46) ADORA3MAPTTHRBPOLBKMT2A

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