SCHEMBL29645818

SCHEMBL29645818

CS(=O)(=O)c1ccc(-c2nc3c4ccccc4nc(Nc4ccccnc4=O)n3n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.45
POLB P06746 3/20 0.45
KDM1A O60341 5/20 0.45
THRB P10828 1/20 0.42
RAD52 P43351 2/20 0.42
SMARCA2 P51531 1/20 0.42
KMT2A Q03164 1/20 0.42
UHRF1 Q96T88 1/20 0.42
ADORA3 P0DMS8 1/20 0.41
ADORA1 P30542 1/20 0.41
TP53 P04637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HCRTR1 O43613 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL29645795 0.93 MAPT (0.44) MAPTPOLBTHRBRAD52SMARCA2
SCHEMBL29645691 0.93 MAPT (0.44) MAPTPOLBTHRBRAD52SMARCA2
SCHEMBL29645490 0.93 MAPT (0.44) MAPTPOLBTHRBRAD52SMARCA2
SCHEMBL31150082 0.92 MAPT (0.43) MAPTPOLBKDM1ATHRBRAD52
SCHEMBL31150295 0.91 MAPT (0.43) MAPTPOLBTHRBRAD52SMARCA2
SCHEMBL29645808 0.90 TP53 (0.45) MAPTPOLBTHRBRAD52ADORA3
SCHEMBL29645760 0.89 MAPT (0.56) MAPTPOLBTHRBRAD52SMARCA2
SCHEMBL29645976 0.86 KDM1A (0.36) MAPTPOLBKDM1AADORA3TP53
SCHEMBL29645834 0.86 ADORA3 (0.49) MAPTPOLBTHRBRAD52SMARCA2
SCHEMBL29645503 0.86 ADORA3 (0.49) MAPTPOLBTHRBRAD52SMARCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114466850-B [1,2,4] Triazolo [1,5-C ] quinazolin-5-amine 拜耳股份有限公司 2024-09-10 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 claimed
CN-114466850-B [1,2,4] Triazolo [1,5-C ] quinazolin-5-amine 拜耳股份有限公司 2024-09-10 CN disclosed