SCHEMBL6164711

SCHEMBL6164711

COc1ccc(CC(N)C(=O)N2CCOCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.59
CYP2D6 P10635 1/20 0.59
AKT1 P31749 1/20 0.55
AKT2 P31751 1/20 0.55
AKT3 Q9Y243 1/20 0.55
DPP4 P27487 1/20 0.55
FAP Q12884 1/20 0.55
DPP8 Q6V1X1 1/20 0.55
DPP9 Q86TI2 1/20 0.55
DPP7 Q9UHL4 1/20 0.55
HPGD P15428 2/20 0.54
GAA P10253 2/20 0.54
POLB P06746 1/20 0.54
ALDH1A1 P00352 1/20 0.54
MAPT P10636 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TSHR P16473 2/20 0.52
AKR1C3 P42330 1/20 0.51
BLM P54132 1/20 0.51

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
SCHEMBL6162739 1.00 FKBP1A (0.59) FKBP1ACYP2D6AKT1AKT2AKT3
SCHEMBL14311579 0.88 DPP7 (0.61) AKT1AKT2AKT3DPP4FAP
SCHEMBL6166321 0.86 AKT1 (0.60) CYP2D6AKT1AKT2AKT3DPP4
SCHEMBL6160377 0.86 AKT1 (0.60) CYP2D6AKT1AKT2AKT3DPP4
SCHEMBL6162776 0.83 DPP7 (0.60) AKT1AKT2AKT3DPP4FAP
SCHEMBL6162780 0.83 DPP7 (0.60) AKT1AKT2AKT3DPP4FAP
SCHEMBL5129878 0.83 TSHR (0.45) DPP4FAPDPP8DPP9DPP7
SCHEMBL7961682 0.82 AKT1 (0.46) FKBP1ACYP2D6AKT1AKT2AKT3
SCHEMBL4706920 0.82 DPP4 (0.60) FKBP1AAKT1AKT2AKT3DPP4
SCHEMBL6163356 0.82 HDAC8 (0.64) FKBP1AAKT1AKT2AKT3DPP4

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