SCHEMBL4186722

SCHEMBL4186722

CN(C(=O)OC(C)(C)C)C1CCCCNC1=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 11/20 0.44
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
PSEN1 P49768 7/20 0.38
PSEN2 P49810 7/20 0.38
APH1B Q8WW43 7/20 0.38
NCSTN Q92542 7/20 0.38
APH1A Q96BI3 7/20 0.38
PSENEN Q9NZ42 7/20 0.38
CCR1 P32246 1/20 0.36
CCR5 P51681 1/20 0.36
CXCR4 P61073 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL4186725 1.00 CCR2 (0.44) CCR2DDB1CRBNPSEN1PSEN2
SCHEMBL2428195 0.95 DDB1 (0.40) CCR2DDB1CRBNPSEN1PSEN2
SCHEMBL2428197 0.95 DDB1 (0.40) CCR2DDB1CRBNPSEN1PSEN2
SCHEMBL17770853 0.88 CCR2 (0.44) CCR2DDB1CRBNPSEN1PSEN2
SCHEMBL12527633 0.86 CCR2 (0.43) CCR2DDB1CRBNPSEN1PSEN2
SCHEMBL1059501 0.79 DDB1 (0.35) DDB1CRBN
SCHEMBL12493964 0.77 PSEN1 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12493968 0.77 PSEN1 (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12493940 0.76 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12493939 0.76 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A

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-2029581-A1 P38 INHIBITORS AND METHODS OF USE THEREOF Array Biopharma, Inc. (US) 2009-03-04 EP disclosed
WO-2007126871-A1 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2007-11-08 WO disclosed