SCHEMBL20458264

SCHEMBL20458264

CCCOCCN1CCN(C(=O)c2ccc(CNC(C)C)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 6/20 0.50
DRD2 P14416 5/20 0.50
ALDH1A1 P00352 2/20 0.46
POLB P06746 1/20 0.46
NAMPT P43490 1/20 0.45
THRB P10828 1/20 0.45
KCNA5 P22460 4/20 0.45
HRH3 Q9Y5N1 5/20 0.45
HRH1 P35367 2/20 0.44
HRH2 P25021 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL14853580 0.91 NAMPT (0.55) DRD3DRD2ALDH1A1POLBNAMPT
SCHEMBL15947381 0.78 NAMPT (0.58) DRD3DRD2ALDH1A1POLBNAMPT
SCHEMBL8404673 0.76 DRD3 (0.65) DRD3DRD2ALDH1A1POLBNAMPT
SCHEMBL20458263 0.75 NAMPT (0.54) DRD3DRD2ALDH1A1POLBNAMPT
SCHEMBL8543987 0.72 NAMPT (0.52) DRD3DRD2ALDH1A1POLBNAMPT
SCHEMBL19634722 0.72 NAMPT (0.55) DRD3DRD2ALDH1A1NAMPTKCNA5
SCHEMBL145775 0.72 HRH3 (0.47) ALDH1A1POLBHRH3
SCHEMBL10720800 0.72 ALDH1A1 (0.61) DRD3DRD2ALDH1A1POLBTHRB
SCHEMBL8404672 0.72 NAMPT (0.58) DRD3DRD2ALDH1A1POLBNAMPT
SCHEMBL23730162 0.71 DRD3 (0.58) DRD3DRD2NAMPTTHRBKCNA5

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
EP-2765187-B1 METHOD FOR PRODUCING MEGAKARYOCYTES AND/OR PLATELETS FROM PLURIPOTENT STEM CELLS NISSAN CHEMICAL IND LTD (JP) 2018-08-08 EP disclosed