SCHEMBL11083144

SCHEMBL11083144

CC(=O)Sc1c(Cl)cc(C(C)=O)cc1C(=O)N(CC(=O)O)C1CCC1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.35
SLC6A5 Q9Y345 1/20 0.35
TSHR P16473 1/20 0.34
HSD11B1 P28845 1/20 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
SCHEMBL11080625 0.88 TSHR (0.42) SLC6A9SLC6A5TSHR
SCHEMBL11083150 0.84 SLC6A9 (0.38) SLC6A9SLC6A5TSHRHSD11B1
SCHEMBL7280219 0.81 SLC6A9 (0.44) SLC6A9SLC6A5TSHR
SCHEMBL11074848 0.74 NPSR1 (0.38) SLC6A9
SCHEMBL11082562 0.74 TSHR (0.42) SLC6A9TSHR
SCHEMBL7286171 0.73 MEN1 (0.42)
SCHEMBL11080632 0.72 TSHR (0.44) SLC6A9SLC6A5TSHR
SCHEMBL11078367 0.72 CA12 (0.48)
SCHEMBL11074855 0.71 NPSR1 (0.41) SLC6A9
SCHEMBL7280392 0.70 SLC6A2 (0.41) SLC6A9SLC6A5

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-4440941-A Aroyl-aminoacids, amides and esters thereof USV PHARMACEUTICAL CORPORATION (US) 1984-04-03 US disclosed