SCHEMBL6162809

SCHEMBL6162809

COc1ccc(C[C@H](N)C(=O)N2CCSC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.71
DPP7 Q9UHL4 9/20 0.53
FAP Q12884 2/20 0.53
DPP8 Q6V1X1 2/20 0.53
DPP9 Q86TI2 2/20 0.53
AKT1 P31749 1/20 0.51
AKT2 P31751 1/20 0.51
AKT3 Q9Y243 1/20 0.51
PREP P48147 1/20 0.49

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
SCHEMBL6160632 1.00 DPP4 (0.71) DPP4DPP7FAPDPP8DPP9
SCHEMBL14311579 0.83 DPP7 (0.61) DPP4DPP7FAPDPP8DPP9
SCHEMBL6160984 0.83 DPP4 (0.85) DPP4DPP7DPP8DPP9
SCHEMBL6160980 0.83 DPP4 (0.85) DPP4DPP7DPP8DPP9
SCHEMBL6166321 0.82 AKT1 (0.60) DPP4DPP7FAPDPP8DPP9
Hydrochloric Acid SCHEMBL6162992 0.82 DPP4 (0.83) DPP4DPP7DPP8DPP9
Hydrochloric Acid SCHEMBL6162984 0.82 DPP4 (0.83) DPP4DPP7DPP8DPP9
SCHEMBL6160377 0.82 AKT1 (0.60) DPP4DPP7FAPDPP8DPP9
SCHEMBL14305531 0.81 DPP4 (0.72) DPP4DPP7DPP8DPP9
SCHEMBL6164711 0.80 FKBP1A (0.59) DPP4DPP7FAPDPP8DPP9

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