SCHEMBL27975342

SCHEMBL27975342

CC(C)(C)OC(=O)N1CCC(c2nc(CSC(=N)I)cs2)CC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.54
SMN1; SMN2 Q16637 3/20 0.43
THRB P10828 2/20 0.43
GAA P10253 1/20 0.43
F2RL3 Q96RI0 1/20 0.43
MAPT P10636 4/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGDS O60760 1/20 0.38

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
SCHEMBL2732435 0.91 GPR119 (0.55) GPR119SMN1; SMN2THRBGAAF2RL3
Iodide SCHEMBL1270225 0.90 GPR119 (0.54) GPR119SMN1; SMN2THRBGAAF2RL3
Iodide SCHEMBL1270227 0.87 GPR119 (0.55) GPR119SMN1; SMN2THRBGAAF2RL3
SCHEMBL1269323 0.85 GPR119 (0.58) GPR119SMN1; SMN2THRBGAAF2RL3
SCHEMBL3144261 0.85 GPR119 (0.60) GPR119SMN1; SMN2THRBGAAF2RL3
SCHEMBL12897372 0.84 GPR119 (0.54) GPR119SMN1; SMN2THRBGAAF2RL3
SCHEMBL907209 0.83 GPR119 (0.58) GPR119SMN1; SMN2THRBGAAF2RL3
SCHEMBL30926236 0.82 GPR119 (0.58) GPR119SMN1; SMN2THRBGAAF2RL3
SCHEMBL12440438 0.82 GPR119 (0.58) GPR119SMN1; SMN2THRBGAAF2RL3
SCHEMBL12897357 0.81 GPR119 (0.51) GPR119SMN1; SMN2THRBGAAF2RL3

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-104059059-A Thiazolylpiperidine Derivates As Fungicides BAYER CROPSCIENCE AG 2014-09-24 CN disclosed