SCHEMBL9636740

SCHEMBL9636740

OC1CCN(CC2NCCc3occc32)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 12/20 0.49
GID4 Q8IVV7 1/20 0.42
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32
TYK2 P29597 2/20 0.32
JAK3 P52333 2/20 0.32
HRH3 Q9Y5N1 3/20 0.32
HRH2 P25021 2/20 0.32
HRH1 P35367 2/20 0.32
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
KCNA3 P22001 1/20 0.31

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
SCHEMBL9636773 0.82 GID4 (0.47) OPRK1GID4
SCHEMBL9636750 0.78 OPRK1 (0.51) OPRK1HRH3BCHEACHE
SCHEMBL8717581 0.76 PRCP (0.50)
SCHEMBL8789518 0.76 PRCP (0.50)
SCHEMBL9636760 0.74 GID4 (0.53) GID4
SCHEMBL9636767 0.72 GID4 (0.40) OPRK1GID4JAK2JAK1
SCHEMBL8790382 0.69 OPRM1 (0.49)
SCHEMBL9637841 0.68 GID4 (0.49) OPRK1GID4
SCHEMBL29877787 0.67 OPRK1 (1.00) OPRK1
SCHEMBL9637818 0.67 OPRK1 (1.00) OPRK1

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-5109008-A Analgesics, diuretics, antiischemic agents GLAXO GROUP LIMITED (GB) 1992-04-28 US disclosed
EP-0366327-A1 Furo- and thieno[3,2-c]pyridines and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1990-05-02 EP disclosed