SCHEMBL6237859

SCHEMBL6237859

Cc1ccc2c3c1-c1ccccc1CC3NCC2

nearest known ligand 0.70

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.70
DRD2 P14416 4/20 0.62
DRD1 P21728 3/20 0.58
PTPRCAP Q14761 2/20 0.58
HTR2A P28223 1/20 0.57
HTR2B P41595 1/20 0.57
DRD3 P35462 1/20 0.53
HTR1A P08908 1/20 0.49

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
SCHEMBL3174699 0.83 HTR2C (0.68) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL3160390 0.82 HTR2C (0.65) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL22960779 0.81 DRD2 (0.70) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL3176273 0.81 HTR2C (0.63) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL1345825 0.80 HTR2C (0.62) HTR2CDRD2DRD1PTPRCAPHTR2A
Bromide SCHEMBL6905306 0.79 HTR2C (0.61) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL1345733 0.79 HTR1A (0.63) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL3178138 0.77 HTR2C (0.58) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL14782159 0.76 HTR2C (0.58) HTR2CDRD2DRD1PTPRCAPHTR2A
SCHEMBL10919948 0.76 DRD4 (0.50) HTR2CDRD2DRD1PTPRCAPHTR2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1534682-A1 NOVEL MOLECULES DERIVED FROM NORAPORPHINE Sederma S.A.S. (FR) 2005-06-01 EP claimed
WO-2004024695-A1 NOVEL MOLECULES DERIVED FROM NORAPORPHINE SEDERMA S.A.S. (FR) 2004-03-25 WO claimed