SCHEMBL6259141

SCHEMBL6259141

CC(=O)Nc1cnc(-c2cccc(C(F)(F)F)c2)nc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FYN P06241 1/20 0.55
KCNQ3 O43525 2/20 0.54
KCNQ2 O43526 2/20 0.54
KCNE1 P15382 2/20 0.54
KCNQ1 P51787 2/20 0.54
KCNQ5 Q9NR82 1/20 0.54
KIT P10721 3/20 0.53
KDR P35968 3/20 0.53
MAPK14 Q16539 3/20 0.53
TOP2A P11388 1/20 0.51
THRB P10828 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KIF11 P52732 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.48
DHODH Q02127 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MC4R P32245 1/20 0.47
POLB P06746 1/20 0.47
NPC1 O15118 1/20 0.47

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
SCHEMBL6233041 0.84 FYN (0.62) FYNKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL3227740 0.79 KMO (0.56) MEN1KMT2ANPC1
SCHEMBL505220 0.78 RXFP1 (0.69) L3MBTL1MEN1KMT2AMAPTMPO
SCHEMBL30022965 0.78 RXFP1 (0.69) L3MBTL1MEN1KMT2AMAPTMPO
SCHEMBL19706639 0.76 PIK3C3 (0.58) MAPK14TOP2AKIF11
SCHEMBL25585874 0.75 TOP2A (0.48) FYNKITKDRMAPK14TOP2A
SCHEMBL10248025 0.74 MAPT (0.64) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL3247981 0.74 PTGS1 (0.61) KCNQ3KCNQ2KCNE1KCNQ1KCNQ5
SCHEMBL3246389 0.73 CTSC (0.58) FYNKITKDRMAPK14MEN1
SCHEMBL40311 0.73 TSHR (0.53) ABCG2NPC1

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
WO-2005005382-A2 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-01-20 WO disclosed