SCHEMBL27428673

SCHEMBL27428673

CC=CC(=O)Oc1ccc(/C=C/C(=O)OC)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.62
CA1 P00915 1/20 0.62
CA2 P00918 1/20 0.62
TYR P14679 1/20 0.62
CA7 P43166 1/20 0.62
CA9 Q16790 1/20 0.62
CA14 Q9ULX7 1/20 0.62
MAPT P10636 3/20 0.61
KDM4E B2RXH2 3/20 0.61
KMT2A Q03164 4/20 0.55
MEN1 O00255 2/20 0.55
PTPN1 P18031 1/20 0.54
TTR P02766 1/20 0.53
APP P05067 1/20 0.53
GSK3B P49841 1/20 0.51
ALDH1A1 P00352 2/20 0.51
JAK2 O60674 1/20 0.51
GAA P10253 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL15985197 0.85 KMT2A (0.54) MAPTKDM4EKMT2AMEN1TTR
SCHEMBL1100397 0.85 CA12 (0.64) CA12CA1CA2TYRCA7
SCHEMBL10389523 0.85 CA12 (0.64) CA12CA1CA2TYRCA7
SCHEMBL5057418 0.84 CA12 (0.84) CA12CA1CA2TYRCA7
SCHEMBL71224 0.84 CA12 (0.84) CA12CA1CA2TYRCA7
SCHEMBL14226869 0.83 CA12 (0.62) CA12CA1CA2TYRCA7
SCHEMBL18121572 0.82 KMT2A (0.76) MAPTKMT2AMEN1GSK3BHDAC3
SCHEMBL30105639 0.82 GSK3B (0.73) CA12CA1CA2TYRCA7
SCHEMBL1237222 0.82 GSK3B (0.73) CA12CA1CA2TYRCA7
SCHEMBL1397478 0.82 GSK3B (0.73) CA12CA1CA2TYRCA7

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
CN-1109053-C Cross-linkable, photoactive polymer materials ROLIC AG (CH) 2003-05-21 CN disclosed
CN-1151411-A Cross-linkable, photoactive polymer materials ROLIC AG (CH) 1997-06-11 CN disclosed