SCHEMBL3928512

SCHEMBL3928512

N#CCN(CC#N)C(=O)CN

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 8/20 0.41
MCL1 Q07820 1/20 0.35
CYP1A2 P05177 1/20 0.34
ZDHHC20 Q5W0Z9 2/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
ELANE P08246 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
OR51E2 Q9H255 1/20 0.30

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
SCHEMBL7858898 0.77 GLRA1 (0.32) GLRA1SLC6A9OR51E2
SCHEMBL6227303 0.76
SCHEMBL11687445 0.75 DPP4 (0.46) DPP4MCL1CYP1A2ZDHHC20ZDHHC2
SCHEMBL17207012 0.67 DPP4 (0.40) DPP4MCL1CYP1A2ZDHHC20ZDHHC2
SCHEMBL5684312 0.66 ZDHHC20 (0.54) ZDHHC20ZDHHC2MEN1KMT2AOR51E2
SCHEMBL10803777 0.66 DPP4 (0.50) DPP4MCL1CYP1A2ZDHHC20ZDHHC2
SCHEMBL3115290 0.65 LMNA (0.38) DPP4
SCHEMBL1790227 0.65
SCHEMBL16255362 0.63
SCHEMBL8750227 0.63 ZDHHC20 (0.62) DPP4CYP1A2ZDHHC20ZDHHC2ELANE

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-1770169-B1 Process for producing glycine ASAHI CHEMICAL IND (JP) 2009-04-01 EP disclosed
EP-1243657-B1 PROCESS FOR PRODUCING GLYCINE ASAHI CHEMICAL IND (JP) 2007-08-29 EP disclosed
EP-1770169-A1 Process for producing glycine Asahi Kasei Kabushiki Kaisha (JP) 2007-04-04 EP disclosed
US-6916638-B2 Process for producing glycine ASAHI KASEI KABUSHIKI KAISHA (JP) 2005-07-12 US disclosed
US-20030040085-A1 Process for producing glycine ASAHI KASEI KABUSHIKI KAISHA (JP) 2003-02-27 US disclosed
EP-1243657-A1 PROCESS FOR PRODUCING GLYCINE Asahi Kasei Kabushiki Kaisha (JP) 2002-09-25 EP disclosed