SCHEMBL9507464

SCHEMBL9507464

CCOC(=O)C(C)Oc1cc(Oc2ccc(Cl)cc2Cl)ccc1C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.48
FFAR1 O14842 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 1/20 0.45
HTT P42858 2/20 0.43
MAPT P10636 3/20 0.42
EPHX2 P34913 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40

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
SCHEMBL9506728 0.91 TDP1 (0.56) TDP1SMN1; SMN2FFAR1MEN1KMT2A
SCHEMBL9503943 0.87 FFAR1 (0.48) TDP1FFAR1MEN1KMT2AHPGD
SCHEMBL9492512 0.83 FFAR1 (0.57) TDP1SMN1; SMN2FFAR1MEN1KMT2A
SCHEMBL9572425 0.81 FFAR1 (0.46) TDP1SMN1; SMN2FFAR1MEN1KMT2A
SCHEMBL15797706 0.80 SMN1; SMN2 (0.66) TDP1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL10022853 0.80 SMN1; SMN2 (0.66) TDP1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL13147651 0.80 SMN1; SMN2 (0.66) TDP1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL10702658 0.80 SMN1; SMN2 (0.50) TDP1SMN1; SMN2FFAR1MEN1KMT2A
SCHEMBL9503662 0.79 FFAR1 (0.48) TDP1FFAR1MEN1KMT2AHPGD
SCHEMBL9507509 0.79 FFAR1 (0.46) TDP1FFAR1MEN1KMT2AHPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0281103-B1 PHENOXYCARBOXYLIC ACID COMPOUNDS AND HERBICIDE COMPRISING IT AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1993-06-23 EP disclosed
US-4845264-A PRE- AND POST-EMERGENCE FOR BROAD-LEAVED WEEDS TEIJIN LIMITED (JP) 1989-07-04 US disclosed
EP-0281103-A2 Phenoxycarboxylic acid compounds and herbicide comprising it as active ingredient TEIJIN LIMITED (JP) 1988-09-07 EP disclosed