SCHEMBL11535133

SCHEMBL11535133

Cc1nnc2sc3cccc(Cl)c3n12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 1/20 0.42
CHEK1 O14757 1/20 0.39
PDGFRA P16234 1/20 0.39
CDK5 Q00535 1/20 0.39
DYRK1A Q13627 1/20 0.39
LRRK2 Q5S007 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
PARP2 Q9UGN5 5/20 0.39
PARP10 Q53GL7 3/20 0.39
PARP15 Q460N3 3/20 0.39
TNKS2 Q9H2K2 2/20 0.39
TNKS O95271 1/20 0.39
PARP1 P09874 1/20 0.39
PARP14 Q460N5 1/20 0.39
TIPARP Q7Z3E1 1/20 0.39
PARP16 Q8N5Y8 1/20 0.39
PARP12 Q9H0J9 1/20 0.39
PARP11 Q9NR21 1/20 0.39
PARP4 Q9UKK3 1/20 0.39

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
SCHEMBL11744435 0.83 BRPF1 (0.55) BRPF1CHEK1PDGFRACDK5DYRK1A
SCHEMBL11749623 0.83 CHEK1 (0.41) BRPF1CHEK1PDGFRACDK5DYRK1A
SCHEMBL11750120 0.81 BRPF1 (0.42) BRPF1CHEK1PDGFRACDK5DYRK1A
Bromide SCHEMBL11744403 0.79 CHEK1 (0.57) BRPF1CHEK1PDGFRACDK5DYRK1A
SCHEMBL11532503 0.77 CHEK1 (0.36) BRPF1CHEK1PDGFRACDK5DYRK1A
SCHEMBL11748057 0.74 BRPF1 (0.53) BRPF1CHEK1PDGFRACDK5DYRK1A
SCHEMBL11746637 0.73 PARP10 (0.37) BRPF1CHEK1PDGFRACDK5DYRK1A
SCHEMBL11536976 0.73 CHEK1 (0.66) CHEK1PDGFRACDK5DYRK1ALRRK2
Hydrochloric Acid SCHEMBL11747896 0.71 CHEK1 (0.64) CHEK1PDGFRACDK5DYRK1ALRRK2
SCHEMBL11532017 0.68 PARP2 (0.53) CHEK1PDGFRACDK5DYRK1ALRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3937713-A Process for the preparation of s-triazolo[3,4-b]benzothiazoles ELI LILLY AND COMPANY (US) 1976-02-10 US claimed
US-4134914-A 1-Acyl-4-substituted phenyl thiosemicarbazides ELI LILLY AND COMPANY (US) 1979-01-16 US disclosed
US-4082762-A 4-(2-HALOPHENYL)-1,2,4-TRIAZOLE-3-THIOL COMPOUNDS ELI LILLY AND COMPANY (US) 1978-04-04 US disclosed
US-3937713-A Process for the preparation of s-triazolo[3,4-b]benzothiazoles ELI LILLY AND COMPANY (US) 1976-02-10 US disclosed