SCHEMBL7946322

SCHEMBL7946322

CCn1ncc(C(=O)c2ccc(S(C)(=O)=O)c(-c3ccccc3C)c2C)c1O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
PTGS2 P35354 1/20 0.32
MAPK14 Q16539 1/20 0.31
NR3C1 P04150 1/20 0.31
NOTUM Q6P988 1/20 0.31
NPC1 O15118 1/20 0.30
HPGD P15428 1/20 0.30
FPR1 P21462 1/20 0.30
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL7949472 0.90 LMNA (0.35) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL7939743 0.90 HSD11B1 (0.38) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL7946284 0.88 LMNA (0.34) LMNASMN1; SMN2RAB9AALDH1A1HTT
SCHEMBL7951276 0.88 LMNA (0.38) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL10872717 0.84 LMNA (0.38) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL7947420 0.83 PTGS2 (0.35) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL7951321 0.82 PTGS2 (0.37) SMN1; SMN2ALDH1A1GAAHTTPTGS2
SCHEMBL7939860 0.82 SMN1; SMN2 (0.35) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL7946692 0.82 SMN1; SMN2 (0.37) LMNASMN1; SMN2RAB9AALDH1A1GAA
SCHEMBL7947421 0.82 SMN1; SMN2 (0.33) 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 4 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
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