SCHEMBL28320608

SCHEMBL28320608

Cc1c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ccc(C(=O)O)c1Br

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
STAT5B P51692 1/20 0.31
NCEH1 Q6PIU2 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
SSTR4 P31391 1/20 0.30
RXRB P28702 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
SCHEMBL2292695 0.83 TSHR (0.33) STAT5BRXRB
SCHEMBL29843472 0.75 MEN1 (0.37) SSTR4
SCHEMBL18091588 0.74 LCK (0.34) SSTR4RXRB
SCHEMBL16529276 0.74 CA12 (0.43)
SCHEMBL20045664 0.73 GRM6 (0.34)
SCHEMBL29534046 0.73 GRM6 (0.34)
SCHEMBL28612868 0.72 PTPRC (0.38)
SCHEMBL16398545 0.72 HCAR3 (0.36)
SCHEMBL30799310 0.72 SSTR4 (0.33) SSTR4
SCHEMBL2031099 0.72 SSTR4 (0.36) SSTR4

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
CN-105408325-B cyanotriazole compounds 大塚制药株式会社 2019-10-22 CN disclosed