SCHEMBL3923929

SCHEMBL3923929

CC(C)(C)OC(=O)N[C@H](Cc1ccc(Oc2ccccc2)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.65
ITGB3 P05106 1/20 0.65
ITGA2B P08514 1/20 0.65
PTPN1 P18031 3/20 0.60
SCN9A Q15858 1/20 0.60
MME P08473 1/20 0.59
CPA1 P15085 1/20 0.59
ACE2 Q9BYF1 1/20 0.59
CTSS P25774 4/20 0.58
CTSK P43235 3/20 0.58
CTSB P07858 2/20 0.58
CTSL P07711 1/20 0.58
MMP13 P45452 1/20 0.57
PPARA Q07869 5/20 0.57
PPARG P37231 4/20 0.57
HDAC8 Q9BY41 1/20 0.56
PPARD Q03181 2/20 0.55
ABCB1 P08183 1/20 0.53
BCL2 P10415 1/20 0.53

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
SCHEMBL3923937 1.00 ACE (0.65) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL3925152 1.00 ACE (0.65) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL2290444 1.00 ACE (0.65) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL2291767 0.94 ITGB3 (0.71) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL2291775 0.94 ITGB3 (0.71) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL2289496 0.94 PPARA (0.66) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL4739863 0.93 ACE (0.60) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL2296993 0.92 PPARA (0.67) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL2290585 0.90 ITGB3 (0.62) ACEITGB3ITGA2BPTPN1SCN9A
SCHEMBL2290589 0.90 ITGB3 (0.62) ACEITGB3ITGA2BPTPN1SCN9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009009035-A1 SOMATOSTATIN ANALOG AND USES THEREOF IPSEN PHARMA S.A.S. (FR) 2009-01-15 WO disclosed
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
WO-1994019367-A1 SPIRO PIPERIDINES AND HOMOLOGS PROMOTE RELEASE OF GROWTH HORMONE MERCK & CO., INC. (US) 1994-09-01 WO disclosed