SCHEMBL9860833

SCHEMBL9860833

O=C(O)/C(CCOc1ccccc1Cl)=C(\CCOc1ccccc1Cl)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
PKM P14618 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.52
HPGD P15428 3/20 0.51
TP53 P04637 2/20 0.51
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
ALDH1A1 P00352 2/20 0.49
LMNA P02545 2/20 0.49
KDM4E B2RXH2 1/20 0.48
MITF O75030 1/20 0.48
XBP1 P17861 1/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
DRD2 P14416 1/20 0.47

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
SCHEMBL578719 0.87 LMNA (0.64) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL9001338 0.85 MEN1 (0.54) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL3161189 0.82 MEN1 (0.58) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL11488532 0.82 MEN1 (0.58) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL3168428 0.81 MEN1 (0.57) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL9322243 0.79 MEN1 (0.55) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL11196941 0.79 KMT2A (0.59) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL3551990 0.79 MEN1 (0.63) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL11544150 0.78 MEN1 (0.58) MEN1KMT2APKMSMN1; SMN2HPGD
SCHEMBL9808263 0.78 L3MBTL1 (0.68) MEN1KMT2APKMSMN1; SMN2HPGD

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
EP-0233299-B1 OPTICAL RESIN AND PROCESS FOR PREPARING THE SAME NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-03-13 EP claimed