SCHEMBL8316003

SCHEMBL8316003

CCOC(=O)CC1CC2(CCN(C(=O)C(CCCc3ccccc3)NC(=O)OC(C)(C)C)CC2)c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
KMT2A Q03164 2/20 0.40
MAPK1 P28482 1/20 0.40
ADORA1 P30542 1/20 0.39
HSD11B1 P28845 1/20 0.39
HSD11B2 P80365 1/20 0.39
CTSS P25774 1/20 0.39
CCKBR P32239 1/20 0.39
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
TGM2 P21980 2/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
PABPC1 P11940 1/20 0.37
TACR1 P25103 1/20 0.37

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
SCHEMBL8316006 1.00 CTSK (0.41) CTSKITGB3ITGA2BKMT2AMAPK1
SCHEMBL8316539 0.94 ITGB3 (0.45) CTSKITGB3ITGA2BKMT2AMAPK1
SCHEMBL8316537 0.94 ITGB3 (0.45) CTSKITGB3ITGA2BKMT2AMAPK1
SCHEMBL8314601 0.93 ITGB3 (0.41) CTSKITGB3ITGA2BKMT2AMAPK1
SCHEMBL8314603 0.93 ITGB3 (0.41) CTSKITGB3ITGA2BKMT2AMAPK1
SCHEMBL2575426 0.90 GHSR (0.46) KMT2AHSD11B1HSD11B2CCKBRSIGMAR1
SCHEMBL2577149 0.90 GHSR (0.46) KMT2AHSD11B1HSD11B2CCKBRSIGMAR1
SCHEMBL5615551 0.90 GHSR (0.46) KMT2AHSD11B1HSD11B2CCKBRSIGMAR1
SCHEMBL2579092 0.90 GHSR (0.46) KMT2AHSD11B1HSD11B2CCKBRSIGMAR1
SCHEMBL2575425 0.90 GHSR (0.46) KMT2AHSD11B1HSD11B2CCKBRSIGMAR1

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