SCHEMBL8316537

SCHEMBL8316537

CC(C)(C)OC(=O)NC(CCCc1ccccc1)C(=O)N1CCC2(CC1)CC(CC(=O)OCc1ccccc1)c1ccccc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
TGM2 P21980 7/20 0.42
KMT2A Q03164 2/20 0.40
CTSL P07711 1/20 0.40
KLK7 P49862 2/20 0.40
KLK5 Q9Y337 2/20 0.40
MAPK1 P28482 1/20 0.40
HSD11B1 P28845 1/20 0.39
HSD11B2 P80365 1/20 0.39
F13A1 P00488 2/20 0.39
TGM1 P22735 2/20 0.39
TGM6 O95932 1/20 0.39
CTSK P43235 1/20 0.39
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
GHSR Q92847 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
SCHEMBL8316539 1.00 ITGB3 (0.45) ITGB3ITGA2BTGM2KMT2ACTSL
SCHEMBL8316006 0.94 CTSK (0.41) ITGB3ITGA2BTGM2KMT2AMAPK1
SCHEMBL8316003 0.94 CTSK (0.41) ITGB3ITGA2BTGM2KMT2AMAPK1
SCHEMBL8314603 0.87 ITGB3 (0.41) ITGB3ITGA2BTGM2KMT2AMAPK1
SCHEMBL8314601 0.87 ITGB3 (0.41) ITGB3ITGA2BTGM2KMT2AMAPK1
SCHEMBL2577149 0.84 GHSR (0.46) KMT2AHSD11B1HSD11B2GHSR
SCHEMBL2575425 0.84 GHSR (0.46) KMT2AHSD11B1HSD11B2GHSR
SCHEMBL2579092 0.84 GHSR (0.46) KMT2AHSD11B1HSD11B2GHSR
SCHEMBL2575426 0.84 GHSR (0.46) KMT2AHSD11B1HSD11B2GHSR
SCHEMBL5615551 0.84 GHSR (0.46) KMT2AHSD11B1HSD11B2GHSR

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-0662481-B1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO INC (US) 1999-03-24 EP disclosed
US-5578593-A RELEASING GROWTH HORMONES FOR ANIMALS MERCK & CO., INC. (US) 1996-11-26 US disclosed
EP-0662481-A1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO. INC. (US) 1995-07-12 EP disclosed