SCHEMBL9724726

SCHEMBL9724726

OC1CN2CC(c3nc(C4CC4)no3)C1C2

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.35
CHRM1 P11229 1/20 0.35
HCRTR1 O43613 2/20 0.33
HCRTR2 O43614 2/20 0.33
HSD11B1 P28845 1/20 0.31
USP7 Q93009 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
SCHEMBL9369814 0.79 CHRM2 (0.54) CHRM2CHRM1
SCHEMBL9724660 0.76 HCRTR1 (0.33) CHRM2HCRTR1HCRTR2HSD11B1
SCHEMBL10516940 0.75 GPR119 (0.40) CHRM2CHRM1HCRTR1HCRTR2
SCHEMBL9370106 0.75 CHRM2 (0.35) CHRM2CHRM1
SCHEMBL9451960 0.74 CHRM2 (0.55) CHRM2CHRM1
Hydrochloric Acid SCHEMBL10518010 0.73 CHRM2 (0.54) CHRM2CHRM1
Hydrochloric Acid SCHEMBL9653117 0.72 CHRM2 (0.64) CHRM2CHRM1
SCHEMBL10518263 0.72 CHRM2 (0.36) CHRM2CHRM1HCRTR1HCRTR2HSD11B1
Hydrochloric Acid SCHEMBL9724734 0.72 CHRM2 (0.64) CHRM2CHRM1
SCHEMBL9150021 0.71

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-0459568-A2 Substituted oxadiazoles and thiadiazoles for use in the treatment of glaucoma and novel compounds having such use MERCK SHARP & DOHME LTD. (GB) 1991-12-04 EP claimed
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP claimed
US-5134146-A SUBSTITUTED OXADIAZOLES AND THIADIAZOLES FOR USE IN THE TREATMENT OF GLAUCOMA MERCK SHARP AND DOHME LTD. (GB) 1992-07-28 US disclosed
EP-0459568-A2 Substituted oxadiazoles and thiadiazoles for use in the treatment of glaucoma and novel compounds having such use MERCK SHARP & DOHME LTD. (GB) 1991-12-04 EP disclosed
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP disclosed