SCHEMBL7197252

SCHEMBL7197252

N#Cc1ccc2oc(C(CC(=O)c3ccc(O)cc3)C(=O)O)cc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDY1; CDY1B Q9Y6F8 1/20 0.39
CLK1 P49759 1/20 0.38
DYRK1A Q13627 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
MAOA P21397 2/20 0.37
MAOB P27338 1/20 0.37
GSK3B P49841 1/20 0.36
DPP4 P27487 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
F2 P00734 2/20 0.34
PLAU P00749 2/20 0.34
PLG P00747 1/20 0.34
KLKB1 P03952 1/20 0.34
PRSS1 P07477 1/20 0.34
KMO O15229 1/20 0.34
F10 P00742 1/20 0.34
P4HB P07237 2/20 0.34

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
SCHEMBL7384849 0.73 ESR1 (0.50) MAOAMAOBF2F10MAPT
SCHEMBL7389419 0.66 HRH3 (0.44) HRH3MAPT
SCHEMBL1819421 0.66 PIM1 (0.58) HRH3PLAUMAPT
SCHEMBL28048537 0.66 L3MBTL1 (0.45) KMT2AMEN1
SCHEMBL12356972 0.66 CYP2A6 (0.49) HRH3PLAU
SCHEMBL7384685 0.65 GSK3B (0.49) CDY1; CDY1BCLK1DYRK1ADYRK1BGSK3B
SCHEMBL7284006 0.64 GSK3B (0.56) GSK3BKMOMAPT
SCHEMBL7197250 0.64 SLC22A12 (0.45) CLK1DYRK1ADYRK1BMAPT
SCHEMBL7393118 0.64 HRH3 (0.45) HRH3F2F10
SCHEMBL9306880 0.64 CETP (0.44) HDAC6

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-1315710-A1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2003-06-04 EP disclosed
WO-2002016340-A1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2002-02-28 WO disclosed