SCHEMBL7154016

SCHEMBL7154016

O=C1CCC(=O)N1c1ccccc1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.63
NR1H2 P55055 1/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 4/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 1/20 0.50
HTR1A P08908 1/20 0.46
HTR2A P28223 1/20 0.46
HTR7 P34969 1/20 0.46
HTR5A P47898 1/20 0.46
HTR6 P50406 1/20 0.46
RAF1 P04049 1/20 0.44
MAPK3 P27361 1/20 0.44
MAP3K8 P41279 1/20 0.44
MAP2K1 Q02750 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
CES2 O00748 1/20 0.44
BCHE P06276 1/20 0.44
GAA P10253 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
SCHEMBL27029552 0.85 ALDH1A1 (0.57) MGLLNR1H2MEN1KMT2AALDH1A1
SCHEMBL6341570 0.80 TLR9 (0.52) MEN1KMT2ARAF1MAPK3MAP3K8
SCHEMBL9067222 0.79 MGLL (0.68) MGLLNR1H2MEN1KMT2AALDH1A1
SCHEMBL27510120 0.78 MGLL (0.56) MGLLNR1H2MEN1KMT2AALDH1A1
SCHEMBL3768557 0.78 MGLL (1.00) MGLLNR1H2ALDH1A1HTTHSD17B10
SCHEMBL30398083 0.78 MGLL (1.00) MGLLNR1H2ALDH1A1HTTHSD17B10
SCHEMBL4731249 0.77 MGLL (0.50) MGLLNR1H2MEN1KMT2AALDH1A1
SCHEMBL28049923 0.77 MGLL (0.54) MGLLNR1H2MEN1KMT2AALDH1A1
SCHEMBL27968787 0.77 MGLL (0.54) MGLLNR1H2MEN1KMT2AALDH1A1
SCHEMBL27145669 0.77 ALDH1A1 (0.59) KMT2AALDH1A1HSD17B10GAATP53

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
US-6528603-B1 Alternating vinyloxy phosphonate and N-substituted maleimide groups; use in metal chelation and in forming multilayer thin films BOARD OF TRUSTEES OPERATING MICHIGAN STATE UNIVERSITY 2003-03-04 US disclosed