SCHEMBL7980208

SCHEMBL7980208

O=C(O)N[C@@H]1C[C@@H]1c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.73
NPSR1 Q6W5P4 1/20 0.73
CNR1 P21554 1/20 0.58
KDM1A O60341 7/20 0.57
EPHX2 P34913 4/20 0.56
MAOB P27338 1/20 0.55
TLR2 O60603 5/20 0.55
TLR1 Q15399 5/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
HRH3 Q9Y5N1 1/20 0.54
MAOA P21397 1/20 0.53

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
SCHEMBL6154005 1.00 SMN1; SMN2 (0.73) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL6153775 1.00 SMN1; SMN2 (0.73) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL3457343 1.00 SMN1; SMN2 (0.73) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL2362144 0.89 SMN1; SMN2 (0.60) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL2362145 0.89 SMN1; SMN2 (0.60) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL2776191 0.85 SMN1; SMN2 (0.55) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL2776196 0.85 SMN1; SMN2 (0.55) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL25021708 0.85 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL14544486 0.85 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1CNR1KDM1AEPHX2
SCHEMBL13794162 0.85 SMN1; SMN2 (1.00) SMN1; SMN2NPSR1CNR1KDM1AEPHX2

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-2001034573-A1 COMPOUNDS ASTRAZENECA AB (SE) 2001-05-17 WO disclosed