SCHEMBL11745019

SCHEMBL11745019

CCc1cccc2sc3nncn3c12

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 1/20 0.66
TNKS2 Q9H2K2 17/20 0.61
PARP2 Q9UGN5 16/20 0.61
PARP15 Q460N3 16/20 0.61
PARP10 Q53GL7 14/20 0.61
PARP14 Q460N5 2/20 0.43
TNKS O95271 1/20 0.40
PARP1 P09874 1/20 0.40
PARP11 Q9NR21 1/20 0.40
PARP4 Q9UKK3 1/20 0.40
PARP3 Q9Y6F1 1/20 0.40
TP53 P04637 1/20 0.38
KMT2A Q03164 1/20 0.37

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
Tricyclazole SCHEMBL14721539 0.80 BRPF1 (1.00) BRPF1TNKS2PARP2PARP15PARP10
SCHEMBL11743096 0.76 BRPF1 (0.67) BRPF1TNKS2PARP2PARP15PARP10
SCHEMBL11743573 0.76 TNKS2 (1.00) BRPF1TNKS2PARP2PARP15PARP10
SCHEMBL11746277 0.70 BRPF1 (0.67) BRPF1TNKS2PARP2PARP15PARP10
SCHEMBL11775198 0.69 TP53 (0.39) BRPF1TP53KMT2A
SCHEMBL25324791 0.67 TNKS2 (0.78) BRPF1TNKS2PARP2PARP15PARP10
SCHEMBL25324784 0.67 TNKS2 (1.00) BRPF1TNKS2PARP2PARP15PARP10
SCHEMBL16713402 0.65 L3MBTL1 (0.38) TP53KMT2A
SCHEMBL4019007 0.64 TNKS2 (0.46) BRPF1TNKS2PARP2PARP15PARP10
SCHEMBL25324178 0.63 TNKS2 (0.67) BRPF1TNKS2PARP2PARP15PARP10

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
US-4064261-A TRIAZOLOBENOXAZOLE, TRIAZOLOBENZOTHIAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 1977-12-20 US disclosed