SCHEMBL6205447

SCHEMBL6205447

N#Cc1cc(F)ccc1COc1cccc(C(=O)/C=C(/O)C(=O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 4/20 0.46
MAOB P27338 5/20 0.42
SPHK2 Q9NRA0 1/20 0.41
SPHK1 Q9NYA1 1/20 0.41
NR4A1 P22736 1/20 0.41
NR4A3 Q92570 1/20 0.41
MAOA P21397 3/20 0.41
MRGPRX4 Q96LA9 4/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL6205313 1.00 NR4A2 (0.46) NR4A2MAOBSPHK2SPHK1NR4A1
SCHEMBL6205448 1.00 NR4A2 (0.46) NR4A2MAOBSPHK2SPHK1NR4A1
SCHEMBL6206166 0.87 SPHK2 (0.50) NR4A2MAOBSPHK2SPHK1NR4A1
SCHEMBL6206160 0.87 SPHK2 (0.50) NR4A2MAOBSPHK2SPHK1NR4A1
SCHEMBL6206165 0.87 SPHK2 (0.50) NR4A2MAOBSPHK2SPHK1NR4A1
SCHEMBL6204951 0.81 MRGPRX4 (0.42) NR4A2MAOBSPHK2SPHK1MAOA
SCHEMBL6204954 0.81 MRGPRX4 (0.42) NR4A2MAOBSPHK2SPHK1MAOA
SCHEMBL6204958 0.81 MRGPRX4 (0.42) NR4A2MAOBSPHK2SPHK1MAOA
SCHEMBL6951859 0.81 NR4A2 (0.70) NR4A2MAOBNR4A1NR4A3MAOA
SCHEMBL6951854 0.81 NR4A2 (0.70) NR4A2MAOBNR4A1NR4A3MAOA

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
EP-1100763-B1 DIKETOACID-DERIVATIVES AS INHIBITORS OF POLYMERASES ANGELETTI P IST RICHERCHE BIO (IT) 2005-06-22 EP claimed