SCHEMBL1867008

SCHEMBL1867008

CC1(O)OC(=O)c2c(N)cccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRK6 P43250 1/20 0.51
PDK2 Q15119 1/20 0.39
THRB P10828 1/20 0.35
ADORA2A P29274 3/20 0.35
PTPRC P08575 1/20 0.35
CSNK1A1 P48729 2/20 0.34
CSNK1D P48730 2/20 0.34
CSNK1G1 Q9HCP0 2/20 0.34
FGR P09769 1/20 0.34
PIM1 P11309 1/20 0.34
MAOA P21397 1/20 0.34
DYRK1A Q13627 1/20 0.34
HIPK2 Q9H2X6 1/20 0.34
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33
CSNK2A3 Q8NEV1 1/20 0.33
KDM4E B2RXH2 2/20 0.33
DPP4 P27487 1/20 0.33
MEN1 O00255 2/20 0.33

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
SCHEMBL9142162 0.84 GRK6 (0.42) GRK6PDK2THRBMAOACSNK2A2
SCHEMBL1612506 0.81 GRK6 (0.46) GRK6PDK2THRBADORA2APTPRC
SCHEMBL9146000 0.76 CA1 (0.49) PDK2PIM1KDM4EMEN1KMT2A
SCHEMBL12714844 0.72 GRK6 (0.40) GRK6THRBADORA2APTPRCCSNK1A1
SCHEMBL12714875 0.70 DHODH (0.49) GRK6PDK2THRBADORA2APTPRC
SCHEMBL9258357 0.70 TYMS (0.58) GRK6MEN1KMT2APOLBSMN1; SMN2
SCHEMBL7697104 0.69 CFTR (0.50) GRK6MEN1KMT2APOLBHPGD
SCHEMBL14907874 0.68 GRK6 (1.00) GRK6PDK2THRBADORA2APTPRC
SCHEMBL691311 0.68 FTO (0.42) GRK6PDK2ADORA2APTPRCCSNK1A1
SCHEMBL3163061 0.67 TXNRD1 (0.41) GRK6PDK2THRBMAOACSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011054874-A1 METHOD FOR THE PREPARATION OF 2-AMINO-6-ETHYLBENZOIC ACID ACTIVE BIOTECH AB (SE) 2011-05-12 WO claimed
EP-2316818-A1 Method for the preparation of 2-amino-6-ethylbenzoic acid Active Biotech AB (SE) 2011-05-04 EP claimed
WO-2011054874-A1 METHOD FOR THE PREPARATION OF 2-AMINO-6-ETHYLBENZOIC ACID ACTIVE BIOTECH AB (SE) 2011-05-12 WO disclosed
WO-2011054874-A1 METHOD FOR THE PREPARATION OF 2-AMINO-6-ETHYLBENZOIC ACID ACTIVE BIOTECH AB (SE) 2011-05-12 WO disclosed
WO-2011054874-A1 METHOD FOR THE PREPARATION OF 2-AMINO-6-ETHYLBENZOIC ACID ACTIVE BIOTECH AB (SE) 2011-05-12 WO disclosed
EP-2316818-A1 Method for the preparation of 2-amino-6-ethylbenzoic acid Active Biotech AB (SE) 2011-05-04 EP disclosed
EP-2316818-A1 Method for the preparation of 2-amino-6-ethylbenzoic acid Active Biotech AB (SE) 2011-05-04 EP disclosed
EP-2316818-A1 Method for the preparation of 2-amino-6-ethylbenzoic acid Active Biotech AB (SE) 2011-05-04 EP disclosed