SCHEMBL8894465

SCHEMBL8894465

CCCN(CCC)C(=O)c1ccc(COc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
ALDH1A1 P00352 5/20 0.62
RAB9A P51151 4/20 0.62
NPC1 O15118 3/20 0.62
MAPT P10636 3/20 0.62
LMNA P02545 1/20 0.62
ALOX5 P09917 2/20 0.56
HDAC1 Q13547 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
MAOB P27338 1/20 0.54
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
NR4A1 P22736 1/20 0.53
NR4A2 P43354 1/20 0.53
NR4A3 Q92570 1/20 0.53
RXRA P19793 1/20 0.52

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
SCHEMBL8894460 0.94 ALOX5 (0.63) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL8894395 0.81 MEN1 (0.50) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL8826117 0.80 BCHE (0.50) MEN1KMT2ANPC1LMNAGAA
SCHEMBL8894388 0.80 MEN1 (0.49) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL1003735 0.79 TP53 (0.68) ALDH1A1MAPTHDAC1HDAC6GAA
SCHEMBL8497848 0.79 ALOX5 (0.53) MEN1KMT2AALOX5L3MBTL1
SCHEMBL8826036 0.79 ALOX5 (0.53) MEN1KMT2AALOX5L3MBTL1
SCHEMBL8497846 0.79 ALOX5 (0.53) MEN1KMT2AALOX5L3MBTL1
SCHEMBL8826041 0.79 ALOX5 (0.53) MEN1KMT2AALOX5L3MBTL1
SCHEMBL9694832 0.78 MLYCD (0.72) MEN1KMT2AALDH1A1NPC1MAPT

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