SCHEMBL6166321

SCHEMBL6166321

COc1ccc(CC(N)C(=O)N2CCN(C(C)=O)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.60
AKT2 P31751 2/20 0.60
AKT3 Q9Y243 2/20 0.60
DPP4 P27487 3/20 0.57
FAP Q12884 2/20 0.57
DPP8 Q6V1X1 2/20 0.57
DPP9 Q86TI2 2/20 0.57
DPP7 Q9UHL4 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.52
DRD3 P35462 1/20 0.52
MAPT P10636 3/20 0.52
HSD17B10 Q99714 2/20 0.52
PKM P14618 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
HPGD P15428 1/20 0.52

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
SCHEMBL6160377 1.00 AKT1 (0.60) AKT1AKT2AKT3DPP4FAP
SCHEMBL14311579 0.90 DPP7 (0.61) AKT1AKT2AKT3DPP4FAP
SCHEMBL19115059 0.88 AKT1 (0.48) AKT1AKT2AKT3DPP4FAP
SCHEMBL6162739 0.86 FKBP1A (0.59) AKT1AKT2AKT3DPP4FAP
SCHEMBL6164711 0.86 FKBP1A (0.59) AKT1AKT2AKT3DPP4FAP
SCHEMBL6162776 0.85 DPP7 (0.60) AKT1AKT2AKT3DPP4FAP
SCHEMBL6162780 0.85 DPP7 (0.60) AKT1AKT2AKT3DPP4FAP
SCHEMBL7440658 0.83 DPP4 (0.57) AKT1AKT2AKT3DPP4FAP
SCHEMBL6161206 0.82 HDAC8 (0.66) AKT1AKT2AKT3DPP4HSD17B10
SCHEMBL6160632 0.82 DPP4 (0.71) AKT1AKT2AKT3DPP4FAP

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 6 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
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed