SCHEMBL9706691

SCHEMBL9706691

CCCc1cc(=O)n(-c2cc(C(=O)OC(C)C)c(Cl)cc2F)c(=O)[nH]1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
HPGD P15428 2/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 3/20 0.32
TSHR P16473 2/20 0.32
PPOX P50336 1/20 0.32
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 2/20 0.31
BCAT2 O15382 3/20 0.31
BCAT1 P54687 3/20 0.31
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
PKM P14618 1/20 0.30
BAZ2B Q9UIF8 1/20 0.30
BAZ2A Q9UIF9 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
POLB P06746 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
SCHEMBL10645885 0.92 MAPT (0.35) MAPTHPGDLMNASMN1; SMN2CYP1A2
SCHEMBL9706635 0.85 KDM5A (0.39) MAPTHPGDSMN1; SMN2HSD17B10TSHR
SCHEMBL9706676 0.84 SMN1; SMN2 (0.40) MAPTHPGDLMNASMN1; SMN2HSD17B10
SCHEMBL9796342 0.82 BCAT1 (0.50) BCAT2BCAT1
SCHEMBL10695131 0.81 PPOX (0.43) MAPTCYP1A2CYP2C19PPOXBCAT2
SCHEMBL9706624 0.80 LMNA (0.34) MAPTHPGDLMNASMN1; SMN2CYP1A2
SCHEMBL10530802 0.80 BCAT1 (0.41) MAPTHPGDLMNASMN1; SMN2HSD17B10
SCHEMBL9706599 0.79 BAZ2B (0.44) MAPTHPGDLMNASMN1; SMN2CYP1A2
SCHEMBL9879094 0.78 LMNA (0.35) MAPTHPGDLMNASMN1; SMN2CYP1A2
SCHEMBL9706686 0.78 ALDH1A1 (0.35) MAPTHPGDLMNASMN1; SMN2HSD17B10

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