SCHEMBL6160825

SCHEMBL6160825

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1F)C(=O)N1CCSC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.56
CTSK P43235 1/20 0.56
DPP4 P27487 1/20 0.52
DPP7 Q9UHL4 1/20 0.52
SCN9A Q15858 12/20 0.51
PREP P48147 1/20 0.46
PTPN1 P18031 1/20 0.45
SCN10A Q9Y5Y9 1/20 0.44
KMT2A Q03164 1/20 0.44
MC4R P32245 1/20 0.44

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
SCHEMBL6161175 1.00 CTSS (0.56) CTSSCTSKDPP4DPP7SCN9A
SCHEMBL6163366 0.85 KMT2A (0.59) CTSSCTSKDPP4PREPKMT2A
SCHEMBL6163257 0.85 KMT2A (0.59) CTSSCTSKDPP4PREPKMT2A
SCHEMBL13852698 0.80 ADORA1 (0.48) CTSSCTSKDPP4PREPKMT2A
SCHEMBL6165855 0.79 KMT2A (0.63) CTSSCTSKKMT2A
SCHEMBL6165862 0.79 KMT2A (0.63) CTSSCTSKKMT2A
SCHEMBL270318 0.78 CTSS (0.73) CTSSCTSKSCN9APTPN1SCN10A
SCHEMBL270319 0.78 CTSS (0.73) CTSSCTSKSCN9APTPN1SCN10A
SCHEMBL1270141 0.78 CTSS (0.73) CTSSCTSKSCN9APTPN1SCN10A
SCHEMBL29907906 0.78 CTSS (0.73) CTSSCTSKSCN9APTPN1SCN10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1134213-B1 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER (US) 2005-11-02 EP disclosed
EP-1060163-B1 NEW PIPERAZINYL-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES KLINGE CO CHEM PHARM FAB (DE) 2005-10-12 EP disclosed
US-6903118-B1 Piperazinyl-substituted pyridylalkane, alkene and alkine carboxamides KLINGE PHARMA GMBH (DE) 2005-06-07 US disclosed
EP-0832065-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-10-10 EP disclosed
EP-1134213-A2 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER INC. (US) 2001-09-19 EP disclosed
US-6277877-B1 GLYCOGEN PHOSPHORYLASE INHIBITOR; ANTIDIABETIC AGENTS PFIZER, INC. 2001-08-21 US disclosed
EP-1060163-A1 NEW PIPERAZINYL-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES Klinge Pharma GmbH (DE) 2000-12-20 EP disclosed
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed
WO-1999031063-A1 NEW PIPERAZINYL-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES KLINGE PHARMA GMBH (DE) 1999-06-24 WO disclosed
EP-0832065-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1998-04-01 EP disclosed
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed