SCHEMBL8670000

SCHEMBL8670000

COc1cc(Oc2cccc(C(F)(F)F)c2)nc(S(C)(=O)=O)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
KDM4E B2RXH2 5/20 0.53
ALDH1A1 P00352 4/20 0.53
MAPT P10636 3/20 0.52
NPSR1 Q6W5P4 4/20 0.48
SDHB P21912 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
HPGD P15428 2/20 0.43
NTRK1 P04629 2/20 0.43
KDR P35968 1/20 0.43
MAPK14 Q16539 1/20 0.43
TNNI3K Q59H18 1/20 0.43

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
SCHEMBL31287948 0.95 ALDH1A1 (0.57) LMNASMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL8666828 0.89 ALDH1A1 (0.52) LMNASMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL8665887 0.88 ALDH1A1 (0.62) LMNAKDM4EALDH1A1MAPTNPSR1
SCHEMBL8665226 0.88 SDHB (0.58) LMNASMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL8669893 0.88 ALDH1A1 (0.53) LMNAKDM4EALDH1A1MAPTNPSR1
SCHEMBL8665287 0.87 ALDH1A1 (0.50) LMNAKDM4EALDH1A1MAPTNPSR1
SCHEMBL8666413 0.86 ALDH1A1 (0.52) LMNAKDM4EALDH1A1MAPTNPSR1
SCHEMBL8720496 0.84 ALDH1A1 (0.50) LMNAKDM4EALDH1A1MAPTNPSR1
SCHEMBL8668641 0.83 ALDH1A1 (0.47) LMNAKDM4EALDH1A1MAPTNPSR1
SCHEMBL8669831 0.82 ALDH1A1 (0.53) LMNAKDM4EALDH1A1MAPTNPSR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5723412-A HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-03-03 US disclosed
EP-0694538-A2 2-benzyloxy-4-phenoxypyrimidine derivative, processes for producing the derivative and herbicidal composition containing the derivative KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-31 EP disclosed