SCHEMBL11748893

SCHEMBL11748893

Cc1cc2sc3nncn3c2cc1C

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TNKS2 Q9H2K2 18/20 0.66
▸ PARP2 Q9UGN5 17/20 0.66
▸ PARP15 Q460N3 17/20 0.66
▸ PARP10 Q53GL7 15/20 0.66
▸ PARP14 Q460N5 2/20 0.66
▸ TNKS O95271 1/20 0.57
▸ PARP1 P09874 1/20 0.57
▸ PARP11 Q9NR21 1/20 0.57
▸ PARP4 Q9UKK3 1/20 0.57
▸ PARP3 Q9Y6F1 1/20 0.57
▸ BRPF1 P55201 1/20 0.53
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 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
SCHEMBL25324487 0.79 PARP2 (1.00) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL25324482 0.79 TNKS2 (1.00) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL25324784 0.72 TNKS2 (1.00) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL11750178 0.72 TNKS2 (1.00) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL25326183 0.72 TNKS2 (1.00) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL25324791 0.72 TNKS2 (0.78) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL25324223 0.72 TNKS2 (1.00) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL25324226 0.72 TNKS2 (0.78) TNKS2PARP2PARP15PARP10PARP14
SCHEMBL673415 0.69 TNKS2 (1.00) TNKS2PARP2PARP15PARP10PARP14
Tricyclazole SCHEMBL14721539 0.69 BRPF1 (1.00) TNKS2PARP2PARP15PARP10PARP14

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
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