SCHEMBL16608271

SCHEMBL16608271

F[C@]1(Cc2ccccc2)C[C@@H]2CNC[C@@H]21

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.36
MAOB P27338 7/20 0.36
KDM1A O60341 5/20 0.36
BPTF Q12830 1/20 0.35
MC4R P32245 1/20 0.34
GBA1 P04062 1/20 0.34
RCOR1 Q9UKL0 1/20 0.34
GRIN2B Q13224 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
SCHEMBL18373227 1.00 MAOA (0.36) MAOAMAOBKDM1ABPTFMC4R
SCHEMBL16601300 0.78 GRIN2B (0.46) MAOAMAOBKDM1ABPTFMC4R
SCHEMBL16608272 0.78 GRIN2B (0.46) MAOAMAOBKDM1ABPTFMC4R
SCHEMBL16995950 0.78 GRIN2B (0.46) MAOAMAOBKDM1ABPTFMC4R
SCHEMBL16601297 0.78 GRIN2B (0.46) MAOAMAOBKDM1ABPTFMC4R
SCHEMBL16608218 0.77 LMNA (0.42) MAOAMAOBKDM1ABPTFMC4R
SCHEMBL13451156 0.75 MAOA (0.37) MAOAMAOBKDM1ARCOR1GRIN2B
SCHEMBL23805616 0.71 GRIN2B (0.50) GRIN2B
SCHEMBL16600819 0.71 GRIN2B (0.50) GRIN2B
SCHEMBL16600821 0.71 GRIN2B (0.50) GRIN2B

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-2015048507-A1 SELECTIVE OCTAHYDRO-CYCLOPENTA[C] PYRROLE NEGATIVE MODULATORS OF NR2B MNEMOSYNE PHARMACEUTICALS, INC. (US) 2015-04-02 WO disclosed