SCHEMBL6829519

SCHEMBL6829519

O=C(O)C1CC2CCN1C2C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.33

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
SCHEMBL18375146 0.67
SCHEMBL27661985 0.67 ATM (0.33) ACE
SCHEMBL8509238 0.66 ATM (0.31) ACE
Methane SCHEMBL15741155 0.66
SCHEMBL1616764 0.66 SLC18A3 (0.33)
SCHEMBL15556894 0.65 ALDH1A1 (0.35)
SCHEMBL29957169 0.64 ACE (0.32) ACE
Hydrochloric Acid SCHEMBL1617127 0.64 ALDH1A1 (0.32)
SCHEMBL25413868 0.63 CYP2D6 (0.37)
SCHEMBL3468008 0.62 ACE (0.32) ACE

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
WO-2004052889-A1 COMPOUNDS AS RADIOLIGANDS FOR THE DIAGNOSIS OF DISEASE PHARMACIA & UPJOHN COMPANY LLC (US) 2004-06-24 WO disclosed