SCHEMBL31722015

SCHEMBL31722015

O=C1CCc2cc(OCC3CC(F)(F)C3)ccc2N1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.56
MAOA P21397 9/20 0.56
KIF11 P52732 1/20 0.47
PDE3B Q13370 3/20 0.46
PDE3A Q14432 3/20 0.46
MEN1 O00255 1/20 0.45
ABCC4 O15439 1/20 0.45
CACNA1F O60840 1/20 0.45
ABCB11 O95342 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
THPO P40225 1/20 0.45
OPRK1 P41145 1/20 0.45
BLM P54132 1/20 0.45

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
SCHEMBL31718484 0.87 MAOA (0.61) MAOBMAOAKIF11PDE3BPDE3A
SCHEMBL12599797 0.84 MAOA (0.59) MAOBMAOAKIF11PDE3BPDE3A
SCHEMBL14124586 0.84 MAOA (0.60) MAOBMAOAKIF11PDE3BPDE3A
SCHEMBL14124583 0.83 MAOA (0.65) MAOBMAOAPDE3BPDE3AMEN1
SCHEMBL1991232 0.82 MAOA (0.56) MAOBMAOAPDE3BPDE3AMEN1
SCHEMBL3634904 0.79 MAOA (0.59) MAOBMAOAKIF11PDE3BPDE3A
SCHEMBL29207445 0.79 MAOA (0.59) MAOBMAOAKIF11PDE3BPDE3A
SCHEMBL3634905 0.79 MAOA (0.59) MAOBMAOAKIF11PDE3BPDE3A
SCHEMBL25362567 0.77 MAOB (0.67) MAOBMAOAPDE3BPDE3AMEN1
SCHEMBL6583075 0.77 MAOB (0.67) MAOBMAOAPDE3BPDE3AMEN1

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-2025229046-A1 SUBSTITUTED HYDROQUINOLINES FOR THE TREATMENT OF GLIOBLASTOMA MULTIFORME MOLIUS SAGLIK TEKNOLOJILERI ANONIM SIRKETI (TR) 2025-11-06 WO disclosed