SCHEMBL9027817

SCHEMBL9027817

CO/C=C(\C(=O)OC)c1ccccc1/C=C(/F)c1nc(-c2ccc(F)cc2)cs1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
GAA P10253 4/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
TP53 P04637 1/20 0.40
KMT2A Q03164 7/20 0.39
MEN1 O00255 6/20 0.39
LMNA P02545 6/20 0.38
ALDH1A1 P00352 5/20 0.37
HTT P42858 4/20 0.37
KDM4E B2RXH2 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HPGD P15428 2/20 0.37
MAPK1 P28482 1/20 0.37
RECQL P46063 1/20 0.37
USP2 O75604 2/20 0.36
GALR3 O60755 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
SCHEMBL9028092 0.92 TP53 (0.43) MAPTSMN1; SMN2GAARAB9ANPC1
SCHEMBL9027016 0.87 EIF4E (0.41) MAPTGAATP53KDM4ERECQL
SCHEMBL9026598 0.87 EIF4E (0.41) MAPTGAATP53KDM4ERECQL
SCHEMBL9029323 0.84 MAPT (0.41) MAPTSMN1; SMN2RAB9ANPC1TP53
SCHEMBL9027940 0.84 MAPT (0.46) MAPTSMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL9027553 0.81 PTGDR2 (0.34) MAPTSMN1; SMN2GAARAB9ANPC1
SCHEMBL9034763 0.81 MAPT (0.41) MAPTSMN1; SMN2GAARAB9ANPC1
SCHEMBL9029415 0.76 MAPT (0.45) MAPTSMN1; SMN2GAARAB9ANPC1
SCHEMBL9029643 0.75 MEN1 (0.39) MAPTGAARAB9ANPC1KMT2A
SCHEMBL9029522 0.73 KDM4E (0.34) KMT2AMEN1ALDH1A1KDM4E

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-0544587-B1 Alpha-methylene-2-vinyl-benzeneacetic acid derivatives, process for their preparation and their use as pesticides ROUSSEL UCLAF (FR) 1996-05-29 EP claimed