SCHEMBL3392133

SCHEMBL3392133

Cc1ccc(-n2nc(C3(C(F)(F)F)CC3)cc2NC(=O)N(OS(C)(=O)=O)c2ccc(N3CCN(C(=O)c4sccc4C)CC3)nc2C)cn1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNJ6 P48051 8/20 0.34
KCNJ5 P48544 8/20 0.34
KCNJ3 P48549 8/20 0.34
RAB9A P51151 1/20 0.31
SIGLEC9 Q9Y336 1/20 0.31
LMNA P02545 1/20 0.31
BRAF P15056 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR1A P08908 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
SCHEMBL3390673 0.88 KCNJ6 (0.38) KCNJ6KCNJ5KCNJ3BRAFKMT2A
SCHEMBL3392430 0.88 KCNJ6 (0.39) KCNJ6KCNJ5KCNJ3LMNABRAF
SCHEMBL3392130 0.86 KCNJ6 (0.41) KCNJ6KCNJ5KCNJ3RAB9ASIGLEC9
SCHEMBL3392551 0.85 KCNJ6 (0.42) KCNJ6KCNJ5KCNJ3RAB9ASIGLEC9
SCHEMBL3393260 0.81 KCNJ6 (0.40) KCNJ6KCNJ5KCNJ3LMNABRAF
SCHEMBL3388802 0.81 KCNJ6 (0.41) KCNJ6KCNJ5KCNJ3LMNABRAF
SCHEMBL3392536 0.77 LMNA (0.34) RAB9ASIGLEC9LMNABRAFKMT2A
SCHEMBL3390667 0.73 KCNJ6 (0.45) KCNJ6KCNJ5KCNJ3BRAFKMT2A
SCHEMBL3392533 0.73 MAPK14 (0.44) BRAF
SCHEMBL3422863 0.73 KCNJ6 (0.40) KCNJ6KCNJ5KCNJ3KMT2A

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
EP-1943243-B1 KINASE INHIBITORS LILLY CO ELI (US) 2010-12-29 EP disclosed