SCHEMBL5794284

SCHEMBL5794284

NC[C@@H]1Cc2cccc(-c3ccccc3Cl)c2O1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 2/20 0.54
PRKAG1 P54619 2/20 0.54
PRKAA2 P54646 2/20 0.54
PRKAA1 Q13131 2/20 0.54
PRKAG3 Q9UGI9 2/20 0.54
PRKAG2 Q9UGJ0 2/20 0.54
PRKAB1 Q9Y478 2/20 0.54
AQP1 P29972 3/20 0.51
DPP4 P27487 1/20 0.40
HTR1A P08908 4/20 0.38
HTR7 P34969 4/20 0.38
HTR2A P28223 4/20 0.36
MAOB P27338 2/20 0.36
HTR2C P28335 3/20 0.36
HTR2B P41595 2/20 0.36
PLA2G7 Q13093 1/20 0.33
CA2 P00918 1/20 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
SCHEMBL4219184 1.00 PRKAB2 (0.54) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL5794592 1.00 PRKAB2 (0.54) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL4607050 0.90 PRKAB2 (0.53) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL4219827 0.88 PRKAB2 (0.54) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL12579303 0.88 PRKAB2 (0.54) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL4226043 0.86 AQP1 (0.56) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL4226179 0.86 AQP1 (0.70) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL5795152 0.86 AQP1 (0.56) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL15758014 0.86 PRKAB2 (0.50) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3
SCHEMBL4621228 0.86 PRKAB2 (0.41) PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3

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
WO-2006000902-A1 DIHYDROBENZOFURAN COMPOUNDS AND USES THEREOF PFIZER PRODUCTS INC. (US) 2006-01-05 WO disclosed