SCHEMBL28814168

SCHEMBL28814168

CN(C)CCC(=O)Nc1ccc2c(c1)[nH]c1c(C(N)=O)ccc(-c3cccc(NC(=O)c4ccc(F)cc4)c3CN)c12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 18/20 0.61
JAK2 O60674 2/20 0.51
LCK P06239 2/20 0.51
LYN P07948 2/20 0.51
KIT P10721 2/20 0.51
TEC P42680 2/20 0.51
TXK P42681 2/20 0.51
BMX P51813 2/20 0.51
ITK Q08881 2/20 0.51
AURKA O14965 1/20 0.51
TYK2 P29597 1/20 0.51
HTR1A P08908 1/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR1F P30939 1/20 0.42
HTR7 P34969 1/20 0.42
HTR2B P41595 1/20 0.42
HTR6 P50406 1/20 0.42

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
SCHEMBL27839556 0.93 BTK (0.63) BTKJAK2LCKLYNKIT
SCHEMBL27982235 0.91 BTK (0.62) BTKJAK2LCKLYNKIT
SCHEMBL27982739 0.89 BTK (0.64) BTKJAK2LCKLYNKIT
SCHEMBL27982585 0.89 BTK (0.69) BTKJAK2LCKLYNKIT
SCHEMBL27982240 0.89 BTK (0.67) BTKJAK2LCKLYNKIT
SCHEMBL27982576 0.88 BTK (0.66) BTKJAK2LCKLYNKIT
SCHEMBL27982612 0.88 BTK (0.68) BTKJAK2LCKLYNKIT
SCHEMBL27982099 0.88 BTK (0.58) BTKJAK2LCKLYNKIT
SCHEMBL27982110 0.87 BTK (0.61) BTKJAK2LCKLYNKIT
SCHEMBL27982211 0.87 BTK (0.64) BTKJAK2LCKLYNKIT

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
CN-102325753-B Carbazole carboxamide compounds useful as kinase inhibitors BRISTOL MYERS SQUIBB CO 2014-09-10 CN claimed