SCHEMBL6161351

SCHEMBL6161351

CC(C)(C)OC(=O)N[C@@H](Cc1cccnc1)C(=O)N1CCC(O)CC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
CYP51A1 Q16850 2/20 0.56
MAPK1 P28482 1/20 0.54
PABPC1 P11940 1/20 0.51
HRH2 P25021 3/20 0.49
HRH1 P35367 3/20 0.49
SCN9A Q15858 1/20 0.49
F2 P00734 1/20 0.46
VNN1 O95497 1/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
ACE P12821 1/20 0.44
CHRM1 P11229 1/20 0.44
CYP3A4 P08684 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
SCHEMBL7556302 0.90 KMT2A (0.62) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL7556296 0.90 KMT2A (0.62) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL5891895 0.90 KMT2A (0.54) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL6162484 0.88 KMT2A (0.71) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL6162477 0.88 KMT2A (0.71) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL6162815 0.88 KMT2A (0.71) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL7598387 0.83 CHRM1 (0.52) KMT2AMAPK1PABPC1HRH2HRH1
SCHEMBL6163231 0.83 KMT2A (0.59) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL6163240 0.83 KMT2A (0.59) KMT2ACYP51A1MAPK1PABPC1HRH2
SCHEMBL6162295 0.82 KMT2A (0.58) KMT2ACYP51A1MAPK1PABPC1HRH2

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