SCHEMBL8305894

SCHEMBL8305894

CCn1ncc(C(=O)c2ccc(S(C)(=O)=O)c(I)c2C)c1O.[O-][S+](Cl)Cl

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL7951287 0.94 LMNA (0.38) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL10080581 0.84 SMN1; SMN2 (0.35) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL10872717 0.84 LMNA (0.38) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL12724679 0.82 LMNA (0.36) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL9448454 0.81 SMN1; SMN2 (0.40) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL8183276 0.81 LMNA (0.36) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL1882413 0.80 LMNA (0.35) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL1880294 0.79 LMNA (0.37) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL7951321 0.78 PTGS2 (0.37) SMN1; SMN2ALDH1A1GAAHTT
SCHEMBL9075497 0.78 SMN1; SMN2 (0.34) LMNASMN1; SMN2RAB9AALDH1A1GAA

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
EP-0914317-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 1999-05-12 EP disclosed
WO-1998052926-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 1998-11-26 WO disclosed