SCHEMBL6160810

SCHEMBL6160810

CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.61
PPARG P37231 3/20 0.58
YAP1 P46937 1/20 0.57
BCL2 P10415 1/20 0.55
ITGB3 P05106 3/20 0.55
ITGA2B P08514 3/20 0.55
ACE P12821 2/20 0.55
MME P08473 1/20 0.55
CPA1 P15085 1/20 0.55
ACE2 Q9BYF1 1/20 0.55
GPR34 Q9UPC5 5/20 0.54
PPARA Q07869 1/20 0.51

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
SCHEMBL6160820 1.00 PTPN1 (0.61) PTPN1PPARGYAP1BCL2ITGB3
SCHEMBL6165779 0.92 YAP1 (0.58) PTPN1PPARGYAP1BCL2ITGB3
SCHEMBL6165785 0.92 YAP1 (0.58) PTPN1PPARGYAP1BCL2ITGB3
SCHEMBL6160931 0.90 ACE (0.62) PPARGITGB3ITGA2BACEMME
SCHEMBL6160926 0.90 ACE (0.62) PPARGITGB3ITGA2BACEMME
SCHEMBL193473 0.89 PTPN1 (0.73) PTPN1PPARGYAP1BCL2ITGB3
SCHEMBL193474 0.89 PTPN1 (0.73) PTPN1PPARGYAP1BCL2ITGB3
SCHEMBL2891538 0.89 PTPN1 (0.73) PTPN1PPARGYAP1BCL2ITGB3
SCHEMBL8409577 0.87 ACE (0.64) PTPN1PPARGBCL2ITGB3ITGA2B
SCHEMBL8409581 0.87 ACE (0.64) PTPN1PPARGBCL2ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed
US-5936089-A PIPERIDINE DERIVATIVES; BONE DISORDERS; OBESITY; AGING; CACHEXIA ASSOCIATED WITH AIDS AND CANCER PFIZER INC (US) 1999-08-10 US disclosed