SCHEMBL29646432

SCHEMBL29646432

Clc1ccc(-c2nc3c4ccccc4nc(Cl)n3n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 11/20 0.64
ADORA1 P30542 2/20 0.60
MAPT P10636 3/20 0.58
NR1H2 P55055 1/20 0.49
NR1H3 Q13133 1/20 0.49
ADORA2A P29274 1/20 0.48
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
HTT P42858 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL22979578 1.00 ADORA3 (0.64) ADORA3ADORA1MAPTNR1H2NR1H3
SCHEMBL29646414 0.92 ADORA3 (0.69) ADORA3ADORA1MAPTMEN1GAA
SCHEMBL22979023 0.92 ADORA3 (0.69) ADORA3ADORA1MAPTMEN1GAA
SCHEMBL29646319 0.89 ADORA3 (0.61) ADORA3ADORA1MAPTADORA2AMEN1
SCHEMBL29646504 0.89 ADORA3 (0.64) ADORA3ADORA1MAPTADORA2AHTT
SCHEMBL22979475 0.89 ADORA3 (0.64) ADORA3ADORA1MAPTADORA2AHTT
SCHEMBL22979754 0.89 ADORA3 (0.61) ADORA3ADORA1MAPTADORA2AMEN1
SCHEMBL22987578 0.85 ADORA3 (0.53) ADORA3ADORA1MAPTADORA2AMEN1
SCHEMBL22987509 0.85 ADORA3 (0.53) ADORA3ADORA1MAPTADORA2AMEN1
SCHEMBL22979306 0.85 ADORA3 (0.65) ADORA3ADORA1MAPTADORA2A

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