SCHEMBL5215166

SCHEMBL5215166

Cn1ccnc(N2CCC(CCc3cccc4ccoc34)CC2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SCD O00767 1/20 0.43
▸ HTR2A P28223 9/20 0.35
▸ DRD2 P14416 8/20 0.35
▸ DRD3 P35462 8/20 0.35
▸ EED O75530 2/20 0.35
▸ FAAH O00519 1/20 0.34
▸ MALT1 Q9UDY8 1/20 0.34
▸ HTR2C P28335 1/20 0.34

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
SCHEMBL5212084 0.78 SCD (0.43) SCDHTR2ADRD2DRD3
SCHEMBL5217243 0.77 SCD (0.48) SCDFAAH
SCHEMBL5213218 0.74 SCD (0.46) SCDHTR2ADRD2HTR2C
SCHEMBL1476133 0.70 ACHE (0.42) DRD2DRD3EEDFAAH
SCHEMBL1475782 0.69 ACHE (0.43) FAAH
Hydrochloric Acid SCHEMBL1474709 0.67 EED (0.55) HTR2AEEDFAAHHTR2C
SCHEMBL5214241 0.67 SCD (0.45) SCD
SCHEMBL5213811 0.66 SCD (0.76) SCD
SCHEMBL5213158 0.65 SCD (0.45) SCDMALT1
SCHEMBL5210901 0.64 SCD (0.61) SCD

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-1484327-B1 NITROGENOUS HETEROCYCLIC COMPOUND AND MEDICINE THEREOF EISAI R&D MAN CO LTD (JP) 2007-08-01 — — EP disclosed
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