SCHEMBL6163366

SCHEMBL6163366

CC(C)(C)OC(=O)NC(Cc1ccccc1)C(=O)N1CCSC1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
MAPK1 P28482 1/20 0.55
CTSS P25774 3/20 0.54
CTSK P43235 2/20 0.54
CTSL P07711 1/20 0.54
CTSB P07858 1/20 0.54
ADORA1 P30542 1/20 0.54
ACE P12821 2/20 0.52
HRH2 P25021 1/20 0.52
HRH1 P35367 1/20 0.52
PABPC1 P11940 1/20 0.52
DPP4 P27487 2/20 0.52
AKT1 P31749 1/20 0.50
ATM Q13315 1/20 0.50
PREP P48147 1/20 0.49
PARP1 P09874 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL6163257 1.00 KMT2A (0.59) KMT2AMAPK1CTSSCTSKCTSL
SCHEMBL6165855 0.93 KMT2A (0.63) KMT2AMAPK1CTSSCTSKCTSL
SCHEMBL6165862 0.93 KMT2A (0.63) KMT2AMAPK1CTSSCTSKCTSL
SCHEMBL13852698 0.89 ADORA1 (0.48) KMT2AMAPK1CTSSCTSKCTSL
Thiomorpholine SCHEMBL9051897 0.88 KMT2A (0.58) KMT2AMAPK1CTSSCTSKCTSL
SCHEMBL6873355 0.86 KLK7 (0.53) KMT2AMAPK1CTSSCTSLADORA1
SCHEMBL6160825 0.85 CTSS (0.56) KMT2ACTSSCTSKDPP4PREP
SCHEMBL6161175 0.85 CTSS (0.56) KMT2ACTSSCTSKDPP4PREP
SCHEMBL5408063 0.85 KMT2A (0.67) KMT2AMAPK1CTSSCTSKCTSL
SCHEMBL4900321 0.85 KMT2A (0.67) KMT2AMAPK1CTSSCTSKCTSL

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 7 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-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
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US 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