SCHEMBL1330734

SCHEMBL1330734

C#Cc1cnc(-c2ncc(C#C)cn2)nc1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 3/20 0.39
PARP1 P09874 1/20 0.32
KEAP1 Q14145 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31

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
SCHEMBL24435974 0.79 HDAC8 (0.38) HDAC8PARP1KEAP1EGLN1
SCHEMBL24942541 0.77
SCHEMBL934894 0.77
SCHEMBL24958838 0.77
SCHEMBL1262340 0.77
SCHEMBL5200955 0.77
SCHEMBL24942714 0.75 NPC1 (0.36) KEAP1
SCHEMBL22130156 0.75 NPC1 (0.34) HDAC8KEAP1
SCHEMBL17970841 0.73 HDAC8 (0.34) HDAC8
SCHEMBL3688402 0.71 TUBB4A (0.36) HDAC8

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-9406943-B2 Electrocatalysts using porous polymers and method of preparation UCHICAGO ARGONNE, LLC (US) 2016-08-02 US disclosed
US-20150194681-A1 ELECTROCATALYSTS USING POROUS POLYMERS AND METHOD OF PREPARATION UCHICAGO ARGONNE, LLC (US) 2015-07-09 US disclosed
US-9012344-B2 Electrocatalysts using porous polymers and method of preparation UCHICAGO ARGONNE, LLC (US) 2015-04-21 US disclosed
US-20110281719-A1 ELECTROCATALYSTS USING POROUS POLYMERS AND METHOD OF PREPARATION UCHICAGO ARGONNE, LLC 2011-11-17 US disclosed