SCHEMBL8846166

SCHEMBL8846166

O=C(/C=C/C=C/C1(F)CC1c1ccc(Br)c(Br)c1)Nc1nccs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 13/20 0.47
NPC1 O15118 11/20 0.41
SMN1; SMN2 Q16637 11/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 6/20 0.40
NFKB1 P19838 2/20 0.40
NFKB2 Q00653 2/20 0.40
RELA Q04206 2/20 0.40
TP53 P04637 2/20 0.40
LMNA P02545 4/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 5/20 0.38
EPHX2 P34913 1/20 0.38
HPGD P15428 3/20 0.37

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
SCHEMBL9566272 0.85 NPC1 (0.39) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL9188292 0.80 MAOB (0.41) RAB9ANPC1SMN1; SMN2L3MBTL1KMT2A
SCHEMBL9136198 0.80 RAB9A (0.41) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL9196128 0.79 EGFR (0.42) RAB9ANPC1SMN1; SMN2POLBTDP1
SCHEMBL9190860 0.78 MMP1 (0.39) RAB9ANPC1KDM4ETDP1KMT2A
SCHEMBL9193683 0.78 MMP1 (0.40) RAB9ANPC1KMT2ALMNAMAPT
SCHEMBL9566085 0.77 RAB9A (0.45) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL9190956 0.77 MMP1 (0.40) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL9192049 0.77 RAB9A (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL9196118 0.77 ALDH1A1 (0.45) RAB9ANPC1SMN1; SMN2ALDH1A1POLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0547972-A1 Heterocyclic amide derivatives and their use as pesticides ROUSSEL-UCLAF (FR) 1993-06-23 EP claimed
US-5605912-A INSECTICIDES, MITICIDES ROUSSEL UCLAF (FR) 1997-02-25 US disclosed
EP-0547972-B1 Heterocyclic amide derivatives and their use as pesticides ROUSSEL UCLAF (FR) 1995-03-22 EP disclosed
US-5380733-A Certain pyridyl-5-phenyl-1-cyclopropyl-dienamide pesticides ROUSSEL UCLAF (FR) 1995-01-10 US disclosed
EP-0547972-A1 Heterocyclic amide derivatives and their use as pesticides ROUSSEL-UCLAF (FR) 1993-06-23 EP disclosed