SCHEMBL6164036

SCHEMBL6164036

NC(=O)C1CC(O)CCN1C(=O)[CH]Cc1cccc(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.42
ADAM17 P78536 1/20 0.42
HDAC8 Q9BY41 1/20 0.37
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
OPRK1 P41145 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
F2 P00734 2/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL3133531 0.86 DPP4 (0.38) MMP1ADAM17ALDH1A1LMNAMAOA
SCHEMBL6165827 0.80 LMNA (0.42) MMP1ADAM17HTR1AHTR7SIGMAR1
SCHEMBL3140691 0.80 MAOB (0.39) ADAM17HTR1AHTR7KMT2AMAOA
SCHEMBL3258336 0.80 MAOB (0.39) ADAM17HTR1AHTR7KMT2AMAOA
SCHEMBL7371918 0.77 ADAM17 (0.49) MMP1ADAM17MAOAMAOB
SCHEMBL6052882 0.76 SCN3A (0.41) MMP1ADAM17HTR1AHTR7SIGMAR1
SCHEMBL6161261 0.76 CFD (0.44) HDAC8HTR1AHTR7HTR3EHTR3B
SCHEMBL7364616 0.72 GAA (0.39) MEN1ALDH1A1LMNAKMT2A
SCHEMBL7361665 0.71 GAA (0.36) LMNA
SCHEMBL14655322 0.71 DPP4 (0.40)

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
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-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed