SCHEMBL9800221

SCHEMBL9800221

CCOC1CC2(CCCC2)CC(=O)N1C

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 14/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ADRA1B P35368 7/20 0.32
ADRA1A P35348 3/20 0.31
ADRA1D P25100 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
DRD2 P14416 1/20 0.31
THPO P40225 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL9800254 0.80 ALDH1A1 (0.34) SMN1; SMN2ALDH1A1
SCHEMBL24987391 0.73 SMN1; SMN2 (0.37) HTR1ASMN1; SMN2ADRA1BADRA1A
SCHEMBL9800231 0.71 SMN1; SMN2 (0.36) HTR1ASMN1; SMN2ADRA1BADRA1AADRA1D
SCHEMBL24987392 0.71 SMN1; SMN2 (0.36) HTR1ASMN1; SMN2ADRA1BADRA1A
SCHEMBL24987393 0.70 SMN1; SMN2 (0.38) HTR1ASMN1; SMN2ADRA1BADRA1A
SCHEMBL7657267 0.70
SCHEMBL24987395 0.69 SMN1; SMN2 (0.33) HTR1ASMN1; SMN2ADRA1B
SCHEMBL25914140 0.69 SMN1; SMN2 (0.34) HTR1ASMN1; SMN2ADRA1BADRA1AADRA1D
SCHEMBL9800228 0.68 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1
SCHEMBL25914144 0.68 SMN1; SMN2 (0.33) HTR1ASMN1; SMN2ADRA1BADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0417143-A1 CYCLIC LACTAMS FOR CHOLESTEROL AND ATHEROSCLEROSIS CONTROL THE UPJOHN COMPANY (US) 1991-03-20 EP claimed
WO-1989011856-A2 CYCLIC LACTAMS FOR CHOLESTEROL AND ATHEROSCLEROSIS CONTROL THE UPJOHN COMPANY (US) 1989-12-14 WO claimed
EP-0417143-A1 CYCLIC LACTAMS FOR CHOLESTEROL AND ATHEROSCLEROSIS CONTROL THE UPJOHN COMPANY (US) 1991-03-20 EP disclosed
WO-1989011856-A2 CYCLIC LACTAMS FOR CHOLESTEROL AND ATHEROSCLEROSIS CONTROL THE UPJOHN COMPANY (US) 1989-12-14 WO disclosed