SCHEMBL8897559

SCHEMBL8897559

C=CCN(CC=C)C(=O)c1ccc(OCCCOc2c(Cl)cc(O)cc2Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.42
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LSS P48449 10/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HTT P42858 1/20 0.38
MAPT P10636 1/20 0.37
POLB P06746 1/20 0.37
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL8895921 0.98 LSS (0.42) F2ALDH1A1L3MBTL1LSSMEN1
SCHEMBL8896187 0.85 LSS (0.42) ALDH1A1L3MBTL1LSSMEN1KMT2A
SCHEMBL8894477 0.85 F2 (0.40) F2ALDH1A1L3MBTL1LSSMEN1
SCHEMBL8895765 0.83 LSS (0.39) F2ALDH1A1L3MBTL1LSSMEN1
SCHEMBL8894166 0.83 LSS (0.44) ALDH1A1L3MBTL1LSSMEN1KMT2A
SCHEMBL8896987 0.82 POLB (0.45) ALDH1A1L3MBTL1MAPTPOLB
SCHEMBL8910613 0.81 MAPT (0.41) ALDH1A1L3MBTL1LSSMEN1KMT2A
SCHEMBL8894156 0.81 MAOB (0.44) ALDH1A1L3MBTL1MEN1KMT2AMAPT
SCHEMBL8895868 0.81 TSHR (0.49) ALDH1A1MAPTPOLB
SCHEMBL8895035 0.80 POLB (0.45) ALDH1A1L3MBTL1MAPTPOLB

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-1997027173-A2 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-31 WO disclosed