SCHEMBL4282573

SCHEMBL4282573

CCCS(=O)(=O)N1CCC(CCNC(=O)c2ccccc2I)(c2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 19/20 0.62

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
SCHEMBL5584785 0.90 SLC6A9 (0.75) SLC6A9
SCHEMBL761953 0.79 SLC6A9 (0.52) SLC6A9
SCHEMBL5591008 0.79 SLC6A9 (0.77) SLC6A9
SCHEMBL14684990 0.78 SLC6A9 (0.73) SLC6A9
SCHEMBL4282569 0.78 SLC6A9 (0.71) SLC6A9
SCHEMBL5584802 0.78 SLC6A9 (0.75) SLC6A9
SCHEMBL4134618 0.78 SLC6A9 (0.75) SLC6A9
SCHEMBL1689569 0.78 SLC6A9 (0.75) SLC6A9
SCHEMBL7207655 0.77 SLC6A9 (1.00) SLC6A9
SCHEMBL5585170 0.76 SLC6A9 (0.61) SLC6A9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1684759-A4 4-PHENYL PIPERDINE SULFONYL GLYCINE TRANSPORTER INHIBITORS MERCK & CO INC (US) 2009-06-10 EP disclosed
EP-1684759-A2 4-PHENYL PIPERDINE SULFONYL GLYCINE TRANSPORTER INHIBITORS Merck & Co., Inc. (US) 2006-08-02 EP disclosed
WO-2005046601-A2 4-PHENYL PIPERDINE SULFONYL GLYCINE TRANSPORTER INHIBITORS MERCK & CO., INC. (US) 2005-05-26 WO disclosed