SCHEMBL7801757

SCHEMBL7801757

CO/C=C(/Oc1ccc(C)cc1C(=O)O)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.41
CFD P00746 2/20 0.41
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 3/20 0.38
CYP2D6 P10635 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
STAT3 P40763 1/20 0.37
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.36
GFER P55789 1/20 0.36
APP P05067 1/20 0.36
METAP2 P50579 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
SCHEMBL7801759 1.00 CSNK2A1 (0.41) CSNK2A1CFDKDM4EHPGDHSD17B10
SCHEMBL7801834 0.87 POLB (0.44) CFDKDM4EHPGDHSD17B10KMT2A
SCHEMBL7801833 0.87 POLB (0.44) CFDKDM4EHPGDHSD17B10KMT2A
SCHEMBL7795791 0.85 CFD (0.40) CFDKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL7795789 0.85 CFD (0.40) CFDKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL7802483 0.85 KDM4E (0.40) CFDKDM4EHPGDHSD17B10KMT2A
SCHEMBL7802480 0.85 KDM4E (0.40) CFDKDM4EHPGDHSD17B10KMT2A
SCHEMBL7803835 0.85 POLB (0.51) KDM4EHPGDKMT2AALDH1A1MAPT
SCHEMBL7801788 0.85 POLB (0.51) KDM4EHPGDKMT2AALDH1A1MAPT
SCHEMBL7802582 0.85 GAA (0.47) CFDKDM4EHPGDHSD17B10KMT2A

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