SCHEMBL212145

SCHEMBL212145

COC(=O)CCC[C@@H](COC(=O)Nc1cc(C(F)(F)F)on1)N(NCc1cccc(F)c1F)C(C)=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KIT P10721 2/20 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
SCHEMBL212523 0.94 SMN1; SMN2 (0.35)
SCHEMBL215012 0.93 KIT (0.30) KIT
SCHEMBL213271 0.88 SCD5 (0.34)
SCHEMBL210927 0.88 KDM4E (0.37)
SCHEMBL211532 0.87 SMN1; SMN2 (0.35)
SCHEMBL2725394 0.87 P2RX7 (0.31) KIT
SCHEMBL212588 0.86 MAPT (0.34)
SCHEMBL212048 0.85 POLB (0.35)
SCHEMBL212349 0.84 MAPT (0.34)
SCHEMBL212791 0.83 MAPT (0.40)

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-8088793-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2012-01-03 US disclosed