Morpholine

Morpholine

SCHEMBL11077014

C1COCCN1.CCCCCCNC1(c2cccc(O)c2)CCCCC1

nearest known ligand 0.43

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.43
GRIN3B O60391 2/20 0.43
GRIA1 P42261 2/20 0.43
GRIA2 P42262 2/20 0.43
GRIA3 P42263 2/20 0.43
GRIA4 P48058 2/20 0.43
GRIN1 Q05586 2/20 0.43
GRIN2A Q12879 2/20 0.43
GRIN2B Q13224 2/20 0.43
GRIN2C Q14957 2/20 0.43
GRIN3A Q8TCU5 2/20 0.43
DRD3 P35462 1/20 0.38
ACHE P22303 1/20 0.37

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
Morpholine SCHEMBL11066057 0.99 GRIN2D (0.41) GRIN2DGRIN3BGRIA1GRIA2GRIA3
Morpholine SCHEMBL11069454 0.79 DRD2 (0.36) DRD3ACHE
SCHEMBL11093324 0.77 DRD3 (0.45) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL11069621 0.76 OPRL1 (0.43) DRD3
Morpholine SCHEMBL11643273 0.76 OPRM1 (0.45) ACHE
SCHEMBL11089351 0.75 DRD3 (0.43) DRD3
Morpholine SCHEMBL11073425 0.73 SLC6A4 (0.39) ACHE
SCHEMBL11074291 0.73 OPRM1 (0.39) DRD3
SCHEMBL9765029 0.73 GRIN2D (0.70) GRIN2DGRIN3BGRIA1GRIA2GRIA3
Morpholine SCHEMBL11079848 0.73 OPRM1 (0.41) DRD3ACHE

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-4447454-A Analgetic compounds, compositions and process of treatment THE UPJOHN COMPANY (US) 1984-05-08 US disclosed
US-4113866-A ANALGETIC COMPOUNDS, COMPOSITIONS AND PROCESS OF TREATMENT THE UPJOHN COMPANY (US) 1978-09-12 US disclosed