SCHEMBL5683274

SCHEMBL5683274

Cc1c(Br)cc2nc(N)[nH]c2c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP6 P51161 1/20 0.43
CSNK2A2 P19784 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
TYMS P04818 11/20 0.35
ALDH1A1 P00352 2/20 0.33
PLAU P00749 1/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33
HTR3A P46098 1/20 0.33
BACE1 P56817 1/20 0.33
HTR3D Q70Z44 1/20 0.33
HTR3C Q8WXA8 1/20 0.33
MASP2 O00187 1/20 0.33
MEN1 O00255 1/20 0.33
NUDT1 P36639 1/20 0.33
KMT2A Q03164 1/20 0.33
AOC3 Q16853 1/20 0.33
LMNA P02545 1/20 0.32
HPGD P15428 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
SCHEMBL16809167 0.81 CSNK2A1 (0.39) CSNK2A1TYMSALDH1A1LMNAHPGD
SCHEMBL5681013 0.80 FABP6 (0.50) FABP6CSNK2A2CSNK2BCSNK2A1TYMS
SCHEMBL1192890 0.78 GRIN2D (0.31) ALDH1A1
SCHEMBL6626586 0.77 FABP6 (0.55) FABP6TYMSALDH1A1PLAUHTR3E
SCHEMBL16936702 0.74 TYMS (0.40) FABP6CSNK2A2CSNK2BCSNK2A1TYMS
SCHEMBL6517964 0.73 CYP1A2 (0.46) ALDH1A1MEN1KMT2AHPGD
SCHEMBL2541923 0.69 FABP6 (0.46) FABP6TYMSALDH1A1PLAUHTR3E
SCHEMBL5924316 0.69 FABP6 (0.50) FABP6TYMSALDH1A1PLAUHTR3E
SCHEMBL6621861 0.69 FABP6 (0.50) FABP6TYMSALDH1A1PLAUHTR3E
SCHEMBL23295593 0.68 FABP6 (0.59) FABP6TYMSALDH1A1PLAUHTR3E

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-1620413-A2 COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2006-02-01 EP disclosed
WO-2004098494-A2 COMPOUNDS, COMPOSITIONS, AND METHODS CYTOKINETICS, INC. (US) 2004-11-18 WO disclosed