SCHEMBL9706661

SCHEMBL9706661

Cn1c2c(c(=O)n(-c3cc(C(=O)OC(C)(C)C)c(Cl)cc3F)c1=O)CCC2

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.33
GABRG2 P18507 3/20 0.33
GABRB3 P28472 3/20 0.33
GABRA5 P31644 3/20 0.33
GABRA3 P34903 3/20 0.33
GABRA6 Q16445 3/20 0.33
GABRA2 P47869 1/20 0.33
BTK Q06187 2/20 0.31
JAK2 O60674 1/20 0.31
PLA2G7 Q13093 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
SCHEMBL9706633 0.89 HPGD (0.34) GABRA1GABRG2GABRB3GABRA3
SCHEMBL10647226 0.86 KDM4E (0.43)
SCHEMBL9706651 0.86 PPOX (0.34)
SCHEMBL9706554 0.86 HPGD (0.34)
SCHEMBL9423141 0.86 TSHR (0.36)
SCHEMBL10645585 0.85 HPGD (0.34)
SCHEMBL10649863 0.85 SMN1; SMN2 (0.36)
SCHEMBL10649870 0.85 SMN1; SMN2 (0.35)
SCHEMBL9706675 0.84 PPOX (0.36)
SCHEMBL9706637 0.84 SMN1; SMN2 (0.34)

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-0195346-B1 3-ARYL URACILES AND THEIR USE AS HERBICIDES CIBA-GEIGY AG (CH) 1992-06-24 EP claimed
US-4760163-A 3-(5-carboxy-4-substituted-phenyl)-(thio)uracil-esters and salts HOFFMANN-LAROCHE INC. (US) 1988-07-26 US disclosed
US-4746352-A HERBICIDES HOFFMANN-LA ROCHE INC. (US) 1988-05-24 US disclosed