SCHEMBL7296455

SCHEMBL7296455

CCC1CC(=O)NN=C1c1cccc([O])c1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 19/20 0.57
PDE2A O00408 1/20 0.51
PDE3B Q13370 1/20 0.51
PDE3A Q14432 1/20 0.51

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
SCHEMBL7296954 0.84 GPR119 (0.63) GPR119PDE2APDE3BPDE3A
SCHEMBL9686758 0.83 PDE2A (0.62) GPR119PDE2APDE3BPDE3A
SCHEMBL7303015 0.82 PDE3B (0.62) GPR119PDE3BPDE3A
SCHEMBL9686551 0.80 GPR119 (0.56) GPR119PDE2APDE3BPDE3A
SCHEMBL7328135 0.79 PDE3B (0.55) GPR119PDE2APDE3BPDE3A
SCHEMBL7296587 0.78 GPR119 (0.57) GPR119PDE3BPDE3A
SCHEMBL9781549 0.78 GPR119 (0.55) GPR119PDE2APDE3BPDE3A
SCHEMBL9687779 0.77 GPR119 (0.51) GPR119PDE2APDE3BPDE3A
SCHEMBL6934156 0.76 GPR119 (0.74) GPR119PDE2APDE3BPDE3A
SCHEMBL9686555 0.76 GPR119 (0.60) GPR119PDE2APDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0400519-A1 2-Hydroxy-n-propylamines, medicaments containing these compounds and method for preparing them Dr. Karl Thomae GmbH (DE) 1990-12-05 EP disclosed