SCHEMBL27433822

SCHEMBL27433822

CC(=O)CC(C)(C)OC(=O)NC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.33
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PIK3CD O00329 1/20 0.31
GAA P10253 2/20 0.30
MGAM O43451 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL22001990 0.80 GAA (0.33) EPHX1ALOX15TSHRALDH1A1GAA
SCHEMBL27859701 0.79 ALDH1A1 (0.31) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL7819855 0.78 ALDH1A1 (0.35) EPHX1TSHRALDH1A1GAA
SCHEMBL18429613 0.78 MMP8 (0.36) PIK3CD
SCHEMBL1289839 0.77
SCHEMBL27623170 0.77 KDM4E (0.31) EPHX1ALDH1A1
SCHEMBL14586294 0.77 TDP1 (0.32) EPHX1ALDH1A1GAA
SCHEMBL18680190 0.77 POLB (0.32) EPHX1
SCHEMBL28514234 0.75 TDP1 (0.35) GAA
SCHEMBL28954318 0.75 GAA (0.36) ALDH1A1GAAMGAMSIMGAM2

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
CN-1127488-C Compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 2003-11-12 CN disclosed
CN-1216537-A Compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 1999-05-12 CN disclosed
CN-1211991-A Compounds with growth hormone releasing properties NOVO NORDISK AS (DK) 1999-03-24 CN disclosed