SCHEMBL4312752

SCHEMBL4312752

O=CC(c1ccc(Br)cc1)c1ccnc(F)c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.34
PRCP P42785 2/20 0.34
KCNH2 Q12809 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.32

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
SCHEMBL6189088 0.87 PTGDR2 (0.36) PRCPLOXL2
SCHEMBL6189080 0.80 KMO (0.36) LOXL2
SCHEMBL8133903 0.78 HDAC1 (0.31)
SCHEMBL8309987 0.78 LMNA (0.42)
SCHEMBL6502262 0.76 ACP3 (0.35)
SCHEMBL4832918 0.75 RIOK2 (0.44)
SCHEMBL7861158 0.74 HDAC4 (0.42)
SCHEMBL6249531 0.74 CES2 (0.33)
SCHEMBL7502772 0.74 PNMT (0.42)
SCHEMBL6510115 0.73 MAPK14 (0.34) KCNH2LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2032141-A1 INHIBITORS OF JANUS KINASES Merck & Co., Inc. (US) 2009-03-11 EP disclosed
WO-2007145957-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2007-12-21 WO disclosed