SCHEMBL470773

SCHEMBL470773

Cc1cc([C@H]2CN(Cc3ccccc3)C[C@@H]2NO)c(F)cc1F

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41
DPP4 P27487 2/20 0.40
SCN4A P35499 2/20 0.40
POLB P06746 1/20 0.39
FUCA1 P04066 2/20 0.39
KDM1A O60341 1/20 0.39
EED O75530 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CCR5 P51681 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
CHRM2 P08172 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
BACE1 P56817 1/20 0.37
GRIN2B Q13224 1/20 0.37

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
SCHEMBL470519 0.90 DPP4 (0.48) DRD2DRD3DPP4FUCA1KDM1A
SCHEMBL470568 0.86 NPSR1 (0.42) DRD2DRD3DPP4POLBALDH1A1
SCHEMBL13186638 0.83 DRD2 (0.50) DRD2DRD3DPP4POLBFUCA1
SCHEMBL13186825 0.83 DRD2 (0.53) DRD2DRD3DPP4FUCA1ALDH1A1
SCHEMBL12064538 0.83 DPP4 (0.58) DRD2DRD3DPP4FUCA1CCR5
SCHEMBL14722978 0.83 DPP4 (0.58) DRD2DRD3DPP4FUCA1CCR5
SCHEMBL14722977 0.83 DPP4 (0.58) DRD2DRD3DPP4FUCA1CCR5
SCHEMBL470646 0.83 DRD2 (0.45) DRD2DRD3DPP4FUCA1KDM1A
SCHEMBL463520 0.82 KMT2A (0.44) DRD2DRD3DPP4SCN4APOLB
SCHEMBL463519 0.82 KMT2A (0.44) DRD2DRD3DPP4SCN4APOLB

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed