SCHEMBL14735839

SCHEMBL14735839

NC(=O)Cc1cc(-c2ccc(NCC3(c4ncccc4F)CC(F)C3)nn2)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.44
IL1B P01584 2/20 0.31
WNT3A P56704 1/20 0.31
GSK3B P49841 1/20 0.30

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
SCHEMBL2577780 0.94 KCNH2 (0.45) KCNH2IL1BWNT3AGSK3B
SCHEMBL2575025 0.90 KCNH2 (0.45) KCNH2IL1B
SCHEMBL2562548 0.89 KCNH2 (0.47) KCNH2IL1BGSK3B
SCHEMBL14998315 0.89 KCNH2 (0.47) KCNH2IL1BGSK3B
SCHEMBL14735815 0.87 KCNH2 (0.45) KCNH2WNT3AGSK3B
SCHEMBL16524179 0.86 KCNH2 (0.42) KCNH2IL1BWNT3A
SCHEMBL14998309 0.86 KCNH2 (0.42) KCNH2IL1BWNT3A
SCHEMBL2576565 0.85 KCNH2 (0.44) KCNH2WNT3A
SCHEMBL17685245 0.85 KCNH2 (0.48) KCNH2GSK3B
SCHEMBL14734717 0.85 KCNH2 (0.51) KCNH2GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563365-B1 CERTAIN AMINO-PYRIDAZINES, COMPOSITIONS THEREOF, AND METHODS OF THEIR USE CYTOKINETICS INC (US) 2016-04-20 EP claimed
US-8969346-B2 Amino-pyridazine skeletal muscle modulators CYTOKINETICS, INC. (US) 2015-03-03 US claimed
EP-2563365-A1 CERTAIN AMINO-PYRIDAZINES, COMPOSITIONS THEREOF, AND METHODS OF THEIR USE Cytokinetics, Inc. (US) 2013-03-06 EP disclosed