SCHEMBL7127634

SCHEMBL7127634

C=CCN1CCN(C([O])CC)CC1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 16/20 0.40
OPRM1 P35372 1/20 0.39
OPRK1 P41145 1/20 0.39
TSHR P16473 1/20 0.33

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
SCHEMBL23944974 0.78 OPRD1 (0.41) OPRD1OPRM1OPRK1TSHR
SCHEMBL4395137 0.77 KDM4E (0.35)
SCHEMBL11391893 0.77 OPRD1 (0.40) OPRD1OPRM1OPRK1TSHR
SCHEMBL15132381 0.75 OPRD1 (0.44) OPRD1OPRM1OPRK1TSHR
SCHEMBL4398046 0.74 DRD2 (0.37) OPRD1
SCHEMBL6692977 0.73 OPRD1 (0.41) OPRD1OPRK1
SCHEMBL327601 0.73 OPRD1 (0.41) OPRD1OPRK1
SCHEMBL290880 0.73
SCHEMBL3970107 0.73 OPRD1 (0.41) OPRD1OPRK1
SCHEMBL23735789 0.72 OPRD1 (0.41) OPRD1OPRM1OPRK1TSHR

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
WO-2003047584-A1 QUINOLINE DERIVATIVES ASTRAZENECA AB (SE) 2003-06-12 WO claimed