SCHEMBL9800243

SCHEMBL9800243

CN1C(=O)CC(C)(C)CC1O

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
ENO1 P06733 1/20 0.34
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2C P28335 1/20 0.33
HTR7 P34969 1/20 0.33
HRH1 P35367 1/20 0.33
HTR2B P41595 1/20 0.33
ALDH1A1 P00352 2/20 0.32
POLB P06746 2/20 0.32
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.32
BRD4 O60885 1/20 0.31
PTPN1 P18031 1/20 0.31
PLA2G7 Q13093 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
SCHEMBL9800231 0.75 SMN1; SMN2 (0.36) HTR1A
SCHEMBL15764309 0.75 ENO1 (0.32) MAPTENO1ALDH1A1POLBKDM4E
SCHEMBL15756412 0.72 PIK3CD (0.37) ENO1POLB
SCHEMBL9800254 0.69 ALDH1A1 (0.34) MAPTALDH1A1PLA2G7
SCHEMBL10516967 0.67
SCHEMBL21846835 0.65 PIK3CD (0.34) ENO1PTPN1
SCHEMBL761687 0.64 MEN1 (0.39) MAPTHTR1ADRD2HTR2CHTR7
SCHEMBL569284 0.64
SCHEMBL4034889 0.64
SCHEMBL4041355 0.64

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