SCHEMBL9029415

SCHEMBL9029415

COC=CC(=O)O.Cc1ccccc1C=C(F)c1nc(-c2ccc(F)cc2)cs1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.45
TP53 P04637 1/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
GAA P10253 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
LMNA P02545 3/20 0.38
ALDH1A1 P00352 4/20 0.37
TDP1 Q9NUW8 4/20 0.37
HTT P42858 3/20 0.37
KDM4E B2RXH2 2/20 0.37
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MAPK1 P28482 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL9401102 0.94 MAPT (0.46) MAPTTP53NPC1RAB9AGAA
SCHEMBL9027438 0.94 MAPT (0.45) MAPTTP53NPC1RAB9ASMN1; SMN2
SCHEMBL9401171 0.92 MAPT (0.56) MAPTNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL9401101 0.92 MAPT (0.44) MAPTTP53NPC1RAB9AGAA
SCHEMBL9028732 0.87 EIF4E (0.44) MAPTTP53NPC1RAB9AMEN1
SCHEMBL9027009 0.82 MAPT (0.45) MAPTTP53NPC1RAB9AGAA
SCHEMBL9401114 0.82 MAPT (0.32) MAPTKDM4E
SCHEMBL9028748 0.81 ALDH1A1 (0.36) ALDH1A1
SCHEMBL9028092 0.79 TP53 (0.43) MAPTTP53NPC1RAB9AGAA
SCHEMBL9026772 0.76 MAPT (0.46) MAPTTP53NPC1RAB9AMEN1

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 2 patents. 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
US-5310746-A Insecticides, miticides, nematocides ROUSSEL UCLAF (FR) 1994-05-10 US disclosed