SCHEMBL10697022

SCHEMBL10697022

O=C1C=CC(=O)N1C1(Cc2ccccc2)CCC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.43
GSK3A P49840 4/20 0.43
GSK3B P49841 4/20 0.43
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
ELANE P08246 2/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
FAAH O00519 2/20 0.38
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL331471 0.74 LMNA (0.34) MGLLKMT2AMEN1FAAHLMNA
Bromide SCHEMBL10842432 0.69 MAOA (0.44) MAOAMAOBKMT2AMEN1
SCHEMBL6658175 0.69 GSK3A (0.40) MGLLGSK3AGSK3BMAOAMAOB
SCHEMBL1026581 0.68 SMN1; SMN2 (0.39) MGLLGSK3AGSK3BKMT2AFAAH
SCHEMBL3216979 0.67 MEN1 (0.41) MAOAMAOBELANEKMT2AMEN1
SCHEMBL27480637 0.66 MAOA (0.54) MAOAMAOBLMNAHTTNPSR1
SCHEMBL156160 0.66 MAOA (0.54) MAOAMAOBALDH1A1
SCHEMBL4904341 0.64 GAA (0.52) MAOAMAOBKMT2AMEN1LMNA
SCHEMBL16681917 0.63 MAOA (0.50) MAOAMAOBLMNAHTTNPSR1
SCHEMBL6672640 0.63 MAOA (0.50) MAOAMAOBELANE

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-0262808-A1 Diels alder graft copolymers ARCO Chemical Technology, L.P. (US) 1988-04-06 EP claimed