SCHEMBL7946692

SCHEMBL7946692

CCn1ncc(C(=O)c2ccc(S(C)(=O)=O)c(-c3cccc(C)c3)c2C)c1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
RAB9A P51151 2/20 0.37
TLR8 Q9NR97 2/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
LMNA P02545 1/20 0.33
GRIN2B Q13224 2/20 0.33
NR3C1 P04150 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
THRB P10828 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31
ICMT O60725 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
SCHEMBL7939860 0.91 SMN1; SMN2 (0.35) SMN1; SMN2RAB9ACNR2LMNANR3C1
SCHEMBL7951276 0.90 LMNA (0.38) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL7946251 0.89 RAB9A (0.36) SMN1; SMN2RAB9AGRIN2BTRPV1GRIN2D
SCHEMBL7947420 0.88 PTGS2 (0.35) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL7948299 0.86 SMN1; SMN2 (0.41) SMN1; SMN2RAB9ACNR1CNR2LMNA
SCHEMBL7951321 0.85 PTGS2 (0.37) SMN1; SMN2ALDH1A1GAAHTT
SCHEMBL7939640 0.84 SMN1; SMN2 (0.39) SMN1; SMN2RAB9ALMNANR3C1ALDH1A1
SCHEMBL7939787 0.84 PTGS2 (0.38) SMN1; SMN2RAB9AALDH1A1CYP1A2
SCHEMBL7947421 0.84 SMN1; SMN2 (0.33) SMN1; SMN2RAB9ALMNAALDH1A1GAA
SCHEMBL7946282 0.84 MAPT (0.36) RAB9ALMNAALDH1A1HTTKMT2A

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-6265606-B1 TO CONTROL A BROAD SPECTRUM OF UNDESIRABLE VEGETATION, ARE SELECTIVE TO MAJOR CROPS, HAVE DESIRABLE ENVIRONMENTAL PROFILES, DOW AGROSCIENCES LLC 2001-07-24 US disclosed
US-6010981-A 1-alkyl-4-benzoyl-5-hydroxypyrazole compounds and their use as herbicides DOW AGROSCIENCES LLC (US) 2000-01-04 US disclosed