SCHEMBL9706504

SCHEMBL9706504

CC(=O)n1c2c(c(=O)n(-c3cc(C(=O)OC(C)C)c(Cl)cc3F)c1=O)CCC2

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPOX P50336 2/20 0.33
HPGD P15428 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL9706531 0.91 MAPT (0.34) PPOXHPGDMAPTLMNASMN1; SMN2
SCHEMBL9706651 0.89 PPOX (0.34) PPOXHPGDMAPTLMNASMN1; SMN2
SCHEMBL9706675 0.87 PPOX (0.36) PPOXHPGDMAPTLMNASMN1; SMN2
SCHEMBL9706682 0.86 TSHR (0.33) HPGDLMNASMN1; SMN2
SCHEMBL10645208 0.79 KDM4E (0.30) HPGD
SCHEMBL9706672 0.79 SLC6A2 (0.35) HPGDMAPTLMNASMN1; SMN2SLC6A2
SCHEMBL9706578 0.79 TSHR (0.34) PPOXHPGDMAPTLMNASMN1; SMN2
SCHEMBL9706607 0.78 HPGD (0.34) PPOXHPGDMAPTLMNASMN1; SMN2
SCHEMBL10647266 0.78 MAPT (0.34) HPGDMAPTLMNASMN1; SMN2
SCHEMBL9423141 0.78 TSHR (0.36) PPOXHPGDMAPTSMN1; SMN2

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