SCHEMBL29646470

SCHEMBL29646470

CS(=O)(=O)Nc1ccccc1-c1nc2c3ccccc3nc(Nc3ccccnc3=O)n2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
POLB P06746 3/20 0.41
RAD52 P43351 2/20 0.38
SMARCA2 P51531 1/20 0.38
KMT2A Q03164 1/20 0.38
UHRF1 Q96T88 1/20 0.38
ADK P55263 1/20 0.38
CKS1B P61024 1/20 0.38
GLO1 Q04760 1/20 0.38
SKP2 Q13309 1/20 0.38
TP53 P04637 4/20 0.37
THRB P10828 2/20 0.37
KDM4E B2RXH2 1/20 0.36
HCRTR1 O43613 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALPL P05186 1/20 0.36
GAA P10253 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
SCHEMBL29645677 0.89 MAPT (0.39) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29646113 0.87 MAPT (0.38) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29646066 0.87 MAPT (0.38) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29645936 0.87 MAPT (0.38) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29645533 0.86 MAPT (0.41) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29645843 0.84 KMT2A (0.44) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29645527 0.84 MAPT (0.41) MAPTPOLBADKTP53
SCHEMBL29645430 0.84 NPC1 (0.48) MAPTPOLBRAD52SMARCA2KMT2A
SCHEMBL29645636 0.84 MAPT (0.47) MAPTPOLBKMT2AADKTHRB
SCHEMBL29646208 0.83 MAPT (0.41) MAPTPOLBRAD52SMARCA2KMT2A

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 disclosed