SCHEMBL11669481

SCHEMBL11669481

N=C1NC(=O)c2cc(Oc3ccccc3)ccc21

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.76
MAOB P27338 8/20 0.76
ATM Q13315 1/20 0.55
L3MBTL1 Q9Y468 2/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
GSK3B P49841 1/20 0.51
GSTP1 P09211 1/20 0.46
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TGM2 P21980 2/20 0.44
XDH P47989 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL7625779 0.86 MAOB (0.59) MAOAMAOBATML3MBTL1MAPT
SCHEMBL11515229 0.86 MAOA (1.00) MAOAMAOBATML3MBTL1MAPT
SCHEMBL11669501 0.78 ALDH1A1 (0.53) MAOAMAOBMAPTHPGDMEN1
SCHEMBL11619404 0.77 MAOA (0.49) MAOAMAOBATML3MBTL1MAPT
SCHEMBL11619406 0.77 MAOA (0.49) MAOAMAOBATML3MBTL1MAPT
SCHEMBL2606189 0.77 MAOA (0.81) MAOAMAOBATML3MBTL1MAPT
SCHEMBL29611540 0.77 MAOA (0.81) MAOAMAOBATML3MBTL1MAPT
SCHEMBL11668781 0.75 TDP2 (0.54) MAOAMAOBATML3MBTL1MAPT
SCHEMBL11670022 0.74 MEN1 (0.48) MAOAMAOBL3MBTL1MAPTTDP1
SCHEMBL31634592 0.74 MAOA (0.66) MAOAMAOBATML3MBTL1MAPT

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
US-4065462-A ORGANIC PIGMENTS CIBA-GEIGY CORPORATION (US) 1977-12-27 US disclosed
US-4016157-A COLORING PLASTICS AND LACQUERS CIBA-GEIGY CORPORATION (US) 1977-04-05 US disclosed