SCHEMBL9566823

SCHEMBL9566823

C#Cc1cccc(/C(F)=C/c2ccccc2/C(=C/OC)C(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 1/20 0.39
FABP7 O15540 1/20 0.33
FABP5 Q01469 1/20 0.33
AKR1C2 P52895 2/20 0.32
MAOB P27338 2/20 0.32
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
DRD3 P35462 1/20 0.31
PTPN1 P18031 1/20 0.31
HAO1 Q9UJM8 1/20 0.31
AKR1C1 Q04828 1/20 0.31
MAOA P21397 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL9029452 1.00 KMT2A (0.39) KMT2AMEN1ALDH1A1FABP7FABP5
SCHEMBL9566877 0.81 KMT2A (0.44) KMT2AMEN1ALDH1A1AKR1C2MAOB
SCHEMBL9029115 0.81 MAOB (0.43) KMT2AMEN1ALDH1A1MAOBKDM4E
SCHEMBL8626809 0.73 AKR1C2 (0.44) KMT2AMEN1ALDH1A1AKR1C2KDM4E
SCHEMBL4159791 0.73 AKR1C2 (0.44) KMT2AMEN1ALDH1A1AKR1C2KDM4E
SCHEMBL8835434 0.70 PTGDR2 (0.42) KMT2AMEN1ALDH1A1AKR1C2MAOB
SCHEMBL9027532 0.70 PTGDR2 (0.42) KMT2AMEN1ALDH1A1AKR1C2MAOB
SCHEMBL9028921 0.67 TAS2R14 (0.39) KMT2AMEN1MAOBLMNA
SCHEMBL9029108 0.67 TAS2R14 (0.39) KMT2AMEN1MAOBLMNA
SCHEMBL2108457 0.67 TRPA1 (0.46) KMT2AMEN1ALDH1A1AKR1C1

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-A1 Alpha-methylene-2-vinyl-benzeneacetic acid derivatives, process for their preparation and their use as pesticides ROUSSEL UCLAF (FR) 1993-06-02 EP disclosed