SCHEMBL29646319

SCHEMBL29646319

Fc1ccc(-c2nc3c4ccccc4nc(Cl)n3n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 9/20 0.61
ADORA1 P30542 2/20 0.57
TP53 P04637 2/20 0.54
MAPT P10636 4/20 0.49
RXFP1 Q9HBX9 1/20 0.49
ADORA2A P29274 1/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL22979754 1.00 ADORA3 (0.61) ADORA3ADORA1TP53MAPTRXFP1
SCHEMBL22979023 0.90 ADORA3 (0.69) ADORA3ADORA1TP53MAPTMEN1
SCHEMBL29646414 0.90 ADORA3 (0.69) ADORA3ADORA1TP53MAPTMEN1
SCHEMBL29646432 0.89 ADORA3 (0.64) ADORA3ADORA1MAPTADORA2AMEN1
SCHEMBL22979578 0.89 ADORA3 (0.64) ADORA3ADORA1MAPTADORA2AMEN1
SCHEMBL29646504 0.86 ADORA3 (0.64) ADORA3ADORA1TP53MAPTRXFP1
SCHEMBL22987562 0.86 ADORA3 (0.46) ADORA3ADORA1TP53ADORA2A
SCHEMBL22979475 0.86 ADORA3 (0.64) ADORA3ADORA1TP53MAPTRXFP1
SCHEMBL22979532 0.85 ADORA3 (0.53) ADORA3ADORA1TP53MAPTRXFP1
SCHEMBL22979717 0.85 ADORA3 (0.64) ADORA3ADORA1TP53MAPTADORA2A

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