SCHEMBL7795813

SCHEMBL7795813

CO/C=C(/Oc1ccc(Cl)cc1CNC(=O)OC)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.42
TSHR P16473 3/20 0.40
MAPT P10636 1/20 0.38
ANO1 Q5XXA6 1/20 0.37
ANO2 Q9NQ90 1/20 0.37
LMNA P02545 1/20 0.37
SLC6A4 P31645 4/20 0.36
HTR2A P28223 2/20 0.36
KCNH2 Q12809 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A3 Q01959 2/20 0.35
RECQL P46063 1/20 0.35
ROCK2 O75116 1/20 0.35
ROCK1 Q13464 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL7795816 1.00 SMN1; SMN2 (0.42) SMN1; SMN2TSHRMAPTANO1ANO2
SCHEMBL7689663 0.85 MAPT (0.48) SMN1; SMN2TSHRMAPTLMNAMEN1
SCHEMBL7689662 0.85 MAPT (0.48) SMN1; SMN2TSHRMAPTLMNAMEN1
SCHEMBL7803822 0.84 MEN1 (0.38) SMN1; SMN2TSHRMAPTLMNAMEN1
SCHEMBL7803819 0.84 MEN1 (0.38) SMN1; SMN2TSHRMAPTLMNAMEN1
SCHEMBL7806146 0.81 MEN1 (0.36) MAPTLMNASLC6A4HTR2AKCNH2
SCHEMBL7806145 0.81 MEN1 (0.36) MAPTLMNASLC6A4HTR2AKCNH2
SCHEMBL7687261 0.81 SMN1; SMN2 (0.42) SMN1; SMN2MAPTLMNAMEN1KMT2A
SCHEMBL7687260 0.81 SMN1; SMN2 (0.42) SMN1; SMN2MAPTLMNAMEN1KMT2A
SCHEMBL7806065 0.80 TDP1 (0.37) SMN1; SMN2MAPTLMNAMEN1KMT2A

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-1097117-A2 ARYL VINYL ETHER DERIVATIVES AND THEIR USE AS HERBICIDES AVENTIS AGRICULTURE LTD. (GB) 2001-05-09 EP disclosed
WO-2000003975-A2 ARYL VINYL ETHER DERIVATIVES AND THEIR USE AS HERBICIDES AVENTIS AGRICULTURE LTD. (GB) 2000-01-27 WO disclosed