SCHEMBL20458263

SCHEMBL20458263

C=C(C)NCc1ccc(C(=O)N2CCN(CCOCCO)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.54
DRD2 P14416 6/20 0.47
DRD3 P35462 6/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 1/20 0.45
PARP1 P09874 1/20 0.44
KCNA5 P22460 5/20 0.44

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
SCHEMBL15947381 0.86 NAMPT (0.58) NAMPTDRD2DRD3ALDH1A1POLB
SCHEMBL8543987 0.84 NAMPT (0.52) NAMPTDRD2DRD3MEN1KMT2A
SCHEMBL14853580 0.83 NAMPT (0.55) NAMPTDRD2DRD3ALDH1A1POLB
SCHEMBL8404673 0.83 DRD3 (0.65) NAMPTDRD2DRD3ALDH1A1POLB
SCHEMBL8545769 0.81 NAMPT (0.48) NAMPTDRD2DRD3MEN1KMT2A
SCHEMBL8404672 0.80 NAMPT (0.58) NAMPTDRD2DRD3MEN1KMT2A
SCHEMBL8543989 0.80 NAMPT (0.49) NAMPTDRD2DRD3MEN1KMT2A
SCHEMBL15259144 0.79 NAMPT (0.48) NAMPTDRD2DRD3MEN1KMT2A
SCHEMBL19634722 0.78 NAMPT (0.55) NAMPTDRD2DRD3MEN1KMT2A
SCHEMBL20458264 0.75 DRD3 (0.50) NAMPTDRD2DRD3ALDH1A1SMN1; SMN2

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