SCHEMBL9706508

SCHEMBL9706508

C=CCOC(=O)c1cc(-n2c(=O)c3c(n(C)c2=O)CCC3)c(F)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPOX P50336 7/20 0.37
SMN1; SMN2 Q16637 2/20 0.34
HPGD P15428 2/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
KDM4E B2RXH2 2/20 0.33
CYP3A4 P08684 1/20 0.32
GAA P10253 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
PDE3B Q13370 1/20 0.30
PDE3A Q14432 1/20 0.30
GUSB P08236 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL10647226 0.89 KDM4E (0.43) PPOXSMN1; SMN2HPGDLMNAMAPT
SCHEMBL10649863 0.87 SMN1; SMN2 (0.36) PPOXSMN1; SMN2HPGDLMNAMAPT
SCHEMBL10649870 0.87 SMN1; SMN2 (0.35) SMN1; SMN2HPGDLMNAMAPTKDM4E
SCHEMBL10645249 0.86 SMN1; SMN2 (0.34) SMN1; SMN2HPGDLMNAMAPTKDM4E
SCHEMBL9706637 0.86 SMN1; SMN2 (0.34) SMN1; SMN2HPGDLMNAMAPTKDM4E
SCHEMBL9706633 0.86 HPGD (0.34) PPOXSMN1; SMN2HPGDLMNAMAPT
SCHEMBL9706651 0.85 PPOX (0.34) PPOXSMN1; SMN2HPGDLMNAMAPT
SCHEMBL9423141 0.84 TSHR (0.36) PPOXSMN1; SMN2HPGDMAPTALDH1A1
SCHEMBL9706661 0.83 GABRA1 (0.33)
SCHEMBL9706675 0.83 PPOX (0.36) PPOXSMN1; SMN2HPGDLMNAMAPT

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