SCHEMBL6164761

SCHEMBL6164761

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2ccccc2C1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
DPP8 Q6V1X1 1/20 0.60
DPP9 Q86TI2 1/20 0.60
CTSS P25774 3/20 0.58
CTSK P43235 2/20 0.58
CTSL P07711 1/20 0.58
CTSB P07858 1/20 0.58
MAPK1 P28482 1/20 0.56
ACE P12821 1/20 0.56
PARP1 P09874 1/20 0.55
ADORA1 P30542 1/20 0.54
ATM Q13315 1/20 0.54
AKT1 P31749 1/20 0.53
SCN9A Q15858 2/20 0.53
HRH2 P25021 1/20 0.53
HRH1 P35367 1/20 0.53
PABPC1 P11940 1/20 0.53
HDAC8 Q9BY41 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
SCHEMBL8244870 1.00 KMT2A (0.60) KMT2ADPP8DPP9CTSSCTSK
SCHEMBL1357714 0.92 KMT2A (0.69) KMT2ADPP8DPP9CTSSCTSK
SCHEMBL9544232 0.92 KMT2A (0.69) KMT2ADPP8DPP9CTSSCTSK
SCHEMBL1357718 0.92 KMT2A (0.69) KMT2ADPP8DPP9CTSSCTSK
SCHEMBL6165560 0.91 KMT2A (0.60) KMT2ADPP8DPP9CTSSCTSK
SCHEMBL8244790 0.90 KMT2A (0.53) KMT2ADPP8DPP9CTSSCTSK
SCHEMBL13291363 0.87 KMT2A (0.64) KMT2ACTSSCTSKCTSLCTSB
SCHEMBL27340724 0.87 KMT2A (0.64) KMT2ACTSSCTSKCTSLCTSB
SCHEMBL8247335 0.87 KMT2A (0.51) KMT2ADPP8DPP9CTSSCTSK
SCHEMBL5557838 0.87 CTSS (0.61) KMT2ADPP8DPP9CTSSCTSK

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