SCHEMBL6161185

SCHEMBL6161185

NC(Cc1cccc(C(F)(F)F)c1)C(=O)N1CCSC1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.73
DPP7 Q9UHL4 5/20 0.73
DPP8 Q6V1X1 1/20 0.55
DPP9 Q86TI2 1/20 0.55
TRPV1 Q8NER1 1/20 0.49
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL6161265 0.82 DPP4 (0.67) DPP4DPP7DPP8DPP9
SCHEMBL6160980 0.81 DPP4 (0.85) DPP4DPP7DPP8DPP9
SCHEMBL6160984 0.81 DPP4 (0.85) DPP4DPP7DPP8DPP9
Hydrochloric Acid SCHEMBL6162992 0.80 DPP4 (0.83) DPP4DPP7DPP8DPP9
Hydrochloric Acid SCHEMBL6162984 0.80 DPP4 (0.83) DPP4DPP7DPP8DPP9
SCHEMBL6162970 0.80 DPP4 (0.73) DPP4DPP7DPP8DPP9
SCHEMBL4779245 0.79 SIGMAR1 (0.55) DPP4DPP7DPP8DPP9HTR2A
SCHEMBL4776905 0.77 CACNA2D1 (0.61) DPP4DPP7DPP8DPP9KMT2A
SCHEMBL4795024 0.77 HDAC8 (0.76) DPP4DPP7DPP8DPP9HTR2A
SCHEMBL4779237 0.76 FAAH (0.54) DPP4DPP7DPP8DPP9

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