SCHEMBL1768397

SCHEMBL1768397

CN(CC1CCOCC1)C(=O)NC[C@H](N)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
GFPT1 Q06210 1/20 0.35
KCNK3 O14649 1/20 0.33
CSF1R P07333 2/20 0.32
CNR2 P34972 4/20 0.32
CNR1 P21554 3/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL1768399 1.00 KDM4E (0.35) KDM4EGFPT1KCNK3CSF1RCNR2
SCHEMBL1768963 0.87 KDM4E (0.34) KDM4EKCNK3CSF1RCNR2CNR1
SCHEMBL1768961 0.87 KDM4E (0.34) KDM4EKCNK3CSF1RCNR2CNR1
SCHEMBL1769360 0.79 KDM4E (0.42) KDM4EKCNK3KMT2ANPC1GAA
SCHEMBL1769354 0.79 KDM4E (0.42) KDM4EKCNK3KMT2ANPC1GAA
SCHEMBL1768572 0.77 KDM4E (0.41) KDM4EKMT2ANPC1GAARAB9A
SCHEMBL1768574 0.77 KDM4E (0.41) KDM4EKMT2ANPC1GAARAB9A
SCHEMBL1769647 0.76 PSEN1 (0.33) KDM4ECSF1RCNR2CNR1
SCHEMBL22135151 0.73 KDM4E (0.40) KDM4EKCNK3CNR2CNR1KMT2A
SCHEMBL13584959 0.71 PSEN1 (0.34) KDM4ECSF1RCNR2CNR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2501715-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY Polyphor Ag (CH) 2012-09-26 EP disclosed
WO-2011060937-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY POLYPHOR AG (CH) 2011-05-26 WO disclosed