SCHEMBL11270263

SCHEMBL11270263

Oc1ccc2c(c1)CN(C1CC1)C2

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.44
DRD1 P21728 7/20 0.44
DRD3 P35462 6/20 0.44
DRD5 P21918 5/20 0.44
DRD4 P21917 3/20 0.44
PDK2 Q15119 1/20 0.44
OPRK1 P41145 1/20 0.42
HDAC4 P56524 1/20 0.41
GRIN1 Q05586 1/20 0.40
GRIN2B Q13224 1/20 0.40
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
ABHD6 Q9BV23 1/20 0.40

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
SCHEMBL26777408 0.86 CRBN (0.41) DRD2DRD1DRD3DRD5DRD4
SCHEMBL28873244 0.85 DRD2 (0.54) DRD2DRD1DRD3DRD5DRD4
SCHEMBL26768680 0.79 CRBN (0.40) DRD2DRD1DRD3DRD5DRD4
SCHEMBL2371462 0.79 DRD2 (0.48) DRD2DRD1DRD3DRD5DRD4
Bromide SCHEMBL29853685 0.78 CRBN (0.39) DRD2DRD1DRD3DRD5DRD4
SCHEMBL27227663 0.78 L3MBTL3 (0.57) DRD2DRD1DRD3DRD5DRD4
SCHEMBL30658342 0.78 L3MBTL3 (0.57) DRD2DRD1DRD3DRD5DRD4
SCHEMBL31748922 0.78 ESR2 (0.54) DRD2DRD1DRD3DRD5DRD4
SCHEMBL26767825 0.78 ESR2 (0.39) DRD2DRD1DRD3DRD5DRD4
SCHEMBL12498872 0.76 DPP4 (0.44) HDAC4ABHD6

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
US-4351842-A N-Cyclopropylisoindolines GLAXO LABORATORIES LIMITED (GB) 1982-09-28 US claimed
US-4351842-A N-Cyclopropylisoindolines GLAXO LABORATORIES LIMITED (GB) 1982-09-28 US disclosed