SCHEMBL9706485

SCHEMBL9706485

CC(C)OC(=O)c1cc(-n2c(=O)c3c(n(C)c2=O)CCC3)c(Cl)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
OPRK1 P41145 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
SCHEMBL9706672 0.91 SLC6A2 (0.35) SLC6A2SLC6A3
SCHEMBL10649662 0.91 OPRK1 (0.33) OPRK1
SCHEMBL9706594 0.88 OPRK1 (0.30) OPRK1
SCHEMBL9469456 0.87 SLC6A2 (0.33) SLC6A2SLC6A3
SCHEMBL9706678 0.86 CMA1 (0.34)
SCHEMBL9706651 0.84 PPOX (0.34) SLC6A2SLC6A3
SCHEMBL9468750 0.83 OPRK1 (0.31) OPRK1
SCHEMBL9706675 0.82 PPOX (0.36) SLC6A2SLC6A3
SCHEMBL10645208 0.81 KDM4E (0.30)
SCHEMBL10650046 0.80 TSHR (0.34) SLC6A2SLC6A3

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