SCHEMBL7364607

SCHEMBL7364607

CC(C)(C)OC(=O)N1[C@H](CC2CCCCC2)[C@H](C(O)C(Cl)C(=O)N2C(=O)OCC2Cc2ccccc2)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33
REN P00797 9/20 0.32
PPARA Q07869 3/20 0.32
PPARG P37231 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
KLK7 P49862 2/20 0.31
KLK5 Q9Y337 1/20 0.31
RABGGTB P53611 1/20 0.31
RABGGTA Q92696 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31

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
SCHEMBL7364609 1.00 CSNK2B (0.33) CSNK2BCSNK2A1RENPPARAPPARG
SCHEMBL7364612 1.00 CSNK2B (0.33) CSNK2BCSNK2A1RENPPARAPPARG
SCHEMBL7360651 0.91 PPARA (0.33) CSNK2BCSNK2A1RENPPARAPPARG
SCHEMBL7360648 0.91 PPARA (0.33) CSNK2BCSNK2A1RENPPARAPPARG
SCHEMBL7360653 0.91 PPARA (0.33) CSNK2BCSNK2A1RENPPARAPPARG
SCHEMBL7365061 0.83 REN (0.33) RENPPARAPPARG
SCHEMBL7365066 0.83 REN (0.33) RENPPARAPPARG
SCHEMBL7365064 0.83 REN (0.33) RENPPARAPPARG
SCHEMBL7542372 0.80 IL6ST (0.40) RENKLK7
SCHEMBL7542380 0.80 IL6ST (0.40) RENKLK7

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-0415981-A4 RETROVIRAL PROTEASE INHIBITORS 1991-10-09 EP disclosed
EP-0415981-A1 RETROVIRAL PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1991-03-13 EP disclosed
WO-1989010752-A1 RETROVIRAL PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1989-11-16 WO disclosed