SCHEMBL6328955

SCHEMBL6328955

CCC(=O)C1CCC2CN(C(=O)OC)C(C(=O)O)CC2C1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
CYP3A4 P08684 2/20 0.32
MAPT P10636 2/20 0.32
ATM Q13315 1/20 0.32
ACE P12821 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
SCHEMBL3305726 0.81 ATM (0.41) TSHRCYP3A4MAPTATM
SCHEMBL3303354 0.81 ATM (0.41) TSHRCYP3A4MAPTATM
SCHEMBL6326567 0.80 NR1H2 (0.40) TSHRCYP3A4MAPTATM
SCHEMBL6484163 0.80 TSHR (0.38) TSHRATM
SCHEMBL7164726 0.79 TSHR (0.35) TSHRCYP3A4ATM
SCHEMBL7164243 0.79 PLG (0.35) TSHRCYP3A4ATM
SCHEMBL7162429 0.79 TSHR (0.35) TSHRCYP3A4ATM
SCHEMBL6327750 0.79 TSHR (0.35) TSHRCYP3A4ATM
SCHEMBL6959922 0.79 TSHR (0.42) TSHRATMACE
SCHEMBL7167960 0.77 TSHR (0.36) TSHRCYP3A4MAPTATM

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
US-6953805-B2 Excitatory amino acid receptor antagonists ELI LILLY AND COMPANY (US) 2005-10-11 US disclosed