SCHEMBL28071280

SCHEMBL28071280

C[C](C)CN1CCO[C@H](c2ccc(N)c(F)c2)C1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 11/20 0.53
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MOGAT2 Q3SYC2 2/20 0.36
MGAT2 Q10469 1/20 0.36
CNR2 P34972 3/20 0.34
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
HTR2B P41595 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
SCHEMBL28071382 1.00 DRD3 (0.53) DRD3MEN1KMT2AMOGAT2MGAT2
SCHEMBL28071470 1.00 DRD3 (0.53) DRD3MEN1KMT2AMOGAT2MGAT2
SCHEMBL28050491 0.85 DRD3 (0.53) DRD3CNR2
SCHEMBL28829545 0.85 DRD3 (0.53) DRD3MOGAT2MGAT2CNR2
SCHEMBL28071433 0.85 DRD3 (0.53) DRD3MOGAT2MGAT2CNR2
SCHEMBL28071260 0.84 DRD3 (0.52) DRD3MEN1KMT2AMOGAT2MGAT2
SCHEMBL28071290 0.84 DRD3 (0.52) DRD3MEN1KMT2AMOGAT2MGAT2
SCHEMBL28071248 0.84 DRD3 (0.52) DRD3MEN1KMT2AMOGAT2MGAT2
SCHEMBL28071300 0.82 DRD3 (0.50) DRD3MEN1KMT2AMOGAT2MGAT2
SCHEMBL28071314 0.82 DRD3 (0.50) DRD3MEN1KMT2AMOGAT2MGAT2

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
CN-103596937-B Substituted benzamide derivatives 霍夫曼-拉罗奇有限公司 2016-06-29 CN disclosed