SCHEMBL8659221

SCHEMBL8659221

CC1CC(CCC=O)CCN1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.33
SMYD3 Q9H7B4 2/20 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
SCHEMBL14079710 0.75 CHRNA7 (0.36) ARG1
SCHEMBL13560157 0.75 CHRNA7 (0.36) ARG1
SCHEMBL23710744 0.75 CHRNA7 (0.36) ARG1
SCHEMBL3913369 0.74 ARG1 (0.36) ARG1SMYD3
SCHEMBL13652271 0.74 ARG1 (0.36) ARG1SMYD3
SCHEMBL26972976 0.74 ARG1 (0.33) ARG1SMYD3
SCHEMBL2409711 0.73 GABRA5 (0.43)
SCHEMBL22312944 0.72 CYP1A2 (0.45) ARG1
SCHEMBL3719924 0.71 DRD3 (0.39) ARG1
SCHEMBL5637780 0.71 SIGMAR1 (0.36) ARG1

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-5756508-A Muscarine antagonists MERCK & CO., INC. (US) 1998-05-26 US disclosed
WO-1997016192-A1 MUSCARINE ANTAGONISTS MERCK & CO., INC. (US) 1997-05-09 WO disclosed