SCHEMBL760171

SCHEMBL760171

CCCS(=O)(=O)N1CCC(c2ccccc2)(C(C)NC(=O)c2c(F)cccc2OCF)CC1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 18/20 0.63
USP2 O75604 1/20 0.40
P2RX7 Q99572 1/20 0.40

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
SCHEMBL13032084 0.94 SLC6A9 (0.62) SLC6A9P2RX7
SCHEMBL8247219 0.87 SLC6A9 (0.68) SLC6A9USP2
SCHEMBL761952 0.87 SLC6A9 (0.68) SLC6A9USP2
SCHEMBL5585136 0.86 SLC6A9 (0.81) SLC6A9P2RX7
SCHEMBL5584840 0.83 SLC6A9 (0.68) SLC6A9USP2P2RX7
SCHEMBL760172 0.82 SLC6A9 (0.54) SLC6A9
SCHEMBL5584923 0.81 SLC6A9 (0.66) SLC6A9USP2P2RX7
SCHEMBL5584931 0.80 SLC6A9 (0.72) SLC6A9USP2
SCHEMBL5585099 0.80 SLC6A9 (0.71) SLC6A9
SCHEMBL5584555 0.79 SLC6A9 (0.66) SLC6A9USP2

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-1942733-B1 RADIOLABELED GLYCINE TRANSPORTER INHIBITORS MERCK SHARP & DOHME (US) 2012-03-21 EP disclosed