SCHEMBL9706633

SCHEMBL9706633

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.34
ALDH1A1 P00352 5/20 0.34
HSD17B10 Q99714 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
LMNA P02545 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MAPT P10636 2/20 0.33
HTT P42858 1/20 0.33
GAA P10253 3/20 0.32
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA3 P34903 1/20 0.32
ALOX15 P16050 1/20 0.31
MEN1 O00255 1/20 0.31
ACHE P22303 1/20 0.31
PPOX P50336 1/20 0.31

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
SCHEMBL10649870 0.89 SMN1; SMN2 (0.35) HPGDALDH1A1HSD17B10KDM4ELMNA
SCHEMBL9706661 0.89 GABRA1 (0.33) GABRA1GABRG2GABRB3GABRA3
SCHEMBL10647226 0.89 KDM4E (0.43) HPGDALDH1A1HSD17B10KMT2AKDM4E
SCHEMBL9706651 0.89 PPOX (0.34) HPGDLMNASMN1; SMN2MAPTPPOX
SCHEMBL10645249 0.88 SMN1; SMN2 (0.34) HPGDALDH1A1KMT2AKDM4ELMNA
SCHEMBL9706554 0.88 HPGD (0.34) HPGDALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL9423141 0.88 TSHR (0.36) HPGDALDH1A1SMN1; SMN2MAPTPPOX
SCHEMBL10645585 0.87 HPGD (0.34) HPGDALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL10649863 0.87 SMN1; SMN2 (0.36) HPGDALDH1A1HSD17B10KDM4ELMNA
SCHEMBL9706675 0.87 PPOX (0.36) HPGDLMNASMN1; SMN2MAPTPPOX

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