SCHEMBL9718596

SCHEMBL9718596

OC(c1ccccc1)c1noc(C2CN3CCC2CC3)n1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.46

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
SCHEMBL9718609 0.88 KCNH2 (0.47) KCNH2
Oxalic Acid SCHEMBL10518962 0.83 CHRM2 (0.43)
SCHEMBL9718612 0.80
SCHEMBL10518112 0.80 CHRM2 (0.55)
SCHEMBL10521021 0.78 CHRNA7 (0.44)
SCHEMBL9151016 0.78 CHRNA7 (0.48)
Oxalic Acid SCHEMBL10518439 0.78 CHRM2 (0.50)
SCHEMBL10519187 0.77 KCNH2 (0.39) KCNH2
SCHEMBL9718617 0.76 KCNH2 (0.65) KCNH2
SCHEMBL9718693 0.75 CHRM2 (0.49)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP claimed
US-5135935-A Anticholesterol agents MERCK & CO., INC. (US) 1992-08-04 US disclosed
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP disclosed