SCHEMBL9718693

SCHEMBL9718693

c1ccc(Cc2noc(C3CN4CCC3CC4)n2)cc1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.49
CHRM1 P11229 1/20 0.49

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
SCHEMBL10518272 0.84 CHRM2 (0.54) CHRM2CHRM1
SCHEMBL8825483 0.79 ACHE (0.54)
SCHEMBL9724682 0.78 CHRM2 (0.56) CHRM2CHRM1
SCHEMBL9718617 0.77 KCNH2 (0.65)
SCHEMBL9724741 0.77 CHRM2 (0.55) CHRM2CHRM1
SCHEMBL9718596 0.75 KCNH2 (0.46)
SCHEMBL9446711 0.75 JAK2 (0.42)
SCHEMBL9149299 0.74 CHRNA7 (0.50) CHRM2CHRM1
Oxalic Acid SCHEMBL9724653 0.74 CHRM2 (0.49) CHRM2CHRM1
SCHEMBL9718609 0.74 KCNH2 (0.47)

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 5 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
JP-2149580-A None JP disclosed
US-5135935-A Anticholesterol agents MERCK & CO., INC. (US) 1992-08-04 US disclosed
JP-H02149580-A LIPOPHILIC OXADIAZOLE MERCK SHARP & DOHME LTD 1990-06-08 JP disclosed
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP disclosed