SCHEMBL6830334

SCHEMBL6830334

CC(C)(C)OC(=O)N[C@@H]1CCN(c2nccc(C(F)(F)F)n2)C1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.51
ACACB O00763 2/20 0.51
PDE10A Q9Y233 3/20 0.49
CKS1B P61024 1/20 0.48
SKP1 P63208 1/20 0.48
SKP2 Q13309 1/20 0.48
TRPV1 Q8NER1 2/20 0.46
MAP4K4 O95819 2/20 0.46
ITGB2 P05107 1/20 0.45
ICAM1 P05362 1/20 0.45
ITGAL P20701 1/20 0.45
JAK3 P52333 1/20 0.44
BTK Q06187 1/20 0.44
RBP4 P02753 1/20 0.44
CTSK P43235 2/20 0.44
PIM1 P11309 1/20 0.44
PIM3 Q86V86 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
ADRB1 P08588 1/20 0.44

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
SCHEMBL6830336 1.00 SYK (0.51) SYKACACBPDE10ACKS1BSKP1
SCHEMBL7386934 0.86 BTK (0.51) SYKPDE10ACKS1BSKP1SKP2
SCHEMBL22499976 0.83 SYK (0.51) SYKACACBPDE10ACKS1BSKP1
SCHEMBL18239342 0.83 GPR119 (0.55) SYKPDE10ACKS1BSKP1SKP2
SCHEMBL1351338 0.82 ACACB (0.52) SYKACACBPDE10ACKS1BSKP1
SCHEMBL1351335 0.82 ACACB (0.52) SYKACACBPDE10ACKS1BSKP1
SCHEMBL29689898 0.82 ACACB (0.52) SYKACACBPDE10ACKS1BSKP1
SCHEMBL18901626 0.82 PKM (0.46) SYKACACBCKS1BSKP1SKP2
SCHEMBL22499860 0.81 CCNC (0.57) SYKPDE10ACKS1BSKP1SKP2
SCHEMBL29689849 0.81 CCNC (0.57) SYKPDE10ACKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004024710-A1 UREA COMPOUNDS ACTIVE AS VANILLOID RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PAIN GLAXO GROUP LIMITED (GB) 2004-03-25 WO disclosed