SCHEMBL11065384

SCHEMBL11065384

Cc1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1N

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.69
▸ DRD2 P14416 1/20 0.69
▸ DRD4 P21917 1/20 0.69
▸ DRD3 P35462 1/20 0.69
▸ DCUN1D1 Q96GG9 8/20 0.66
▸ CCR3 P51677 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ POLB P06746 1/20 0.60
▸ SIGMAR1 Q99720 1/20 0.60
▸ F10 P00742 1/20 0.58
▸ HPN P05981 1/20 0.58
▸ PRSS1 P07477 1/20 0.58
▸ PRSS2 P07478 1/20 0.58
▸ PRSS3 P35030 1/20 0.58
▸ HGFAC Q04756 1/20 0.58
▸ ST14 Q9Y5Y6 1/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ UBE2M P61081 6/20 0.57
▸ HTT P42858 1/20 0.54
▸ EPHX2 P34913 1/20 0.53

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
SCHEMBL11337873 0.85 DRD4 (0.71) KMT2ADRD4DCUN1D1CCR3POLB
SCHEMBL9078087 0.83 DRD4 (1.00) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL18658001 0.81 DCUN1D1 (0.76) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL18640380 0.81 DCUN1D1 (0.74) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL18658004 0.79 DCUN1D1 (1.00) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL18657999 0.79 DRD4 (0.81) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL18657822 0.77 DCUN1D1 (0.81) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL12677059 0.76 DRD4 (0.85) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL18657866 0.76 DRD4 (0.85) KMT2ADRD2DRD4DRD3DCUN1D1
SCHEMBL18658206 0.76 F10 (0.79) KMT2ADRD2DRD4DRD3DCUN1D1

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
US-4426387-A Piperid-4-yl ureas and thio ureas used as anti-depressant agents JOHN WYETH & BROTHER LTD. (GB) 1984-01-17 — — US claimed
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