SCHEMBL7683485

SCHEMBL7683485

CN(c1cc(F)c(F)cc1C(=O)O)S(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.46
KMT2A Q03164 2/20 0.41
LMNA P02545 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
POLB P06746 1/20 0.36
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
TSHR P16473 2/20 0.35
CYP19A1 P11511 3/20 0.35
TYK2 P29597 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
USP2 O75604 1/20 0.34
CYP2C19 P33261 1/20 0.33

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
SCHEMBL8218958 0.85 KMT2A (0.43) ACLYKMT2AL3MBTL1POLBTSHR
SCHEMBL7682908 0.80 KEAP1 (0.42) ACLYKMT2ALMNAL3MBTL1POLB
SCHEMBL7558061 0.75 CSNK2A1 (0.44) ACLYKMT2AL3MBTL1POLBTSHR
SCHEMBL19084967 0.75 CSNK2A1 (0.49) KMT2AL3MBTL1POLBTSHRALDH1A1
SCHEMBL6646574 0.75 KMT2A (0.43) KMT2AL3MBTL1POLBTSHRUSP2
SCHEMBL7556650 0.73 TSHR (0.49) ACLYKMT2ALMNATSHRALDH1A1
SCHEMBL7689156 0.73 C5AR1 (0.49) ACLYKMT2ALMNATSHRALDH1A1
SCHEMBL30005614 0.73 KMT2A (0.45) KMT2AL3MBTL1POLBTSHRCYP19A1
SCHEMBL7558164 0.73 KMT2A (0.42) KMT2ALMNAL3MBTL1POLBTSHR
SCHEMBL7684663 0.73 LMNA (0.53) KMT2ALMNAL3MBTL1POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides MUSIL TIBOR (GB) 2002-04-18 US disclosed
CN-1082790-C Herbicides RHONE POULENE AGRICULTURE LTD (GB) 2002-04-17 CN disclosed
US-6323155-B1 EXCELLENT LEVEL OF HERBICIDAL ACTIVITY TOGETHER WITH CROP TOLERANCE RHONE-POULENC AGRICULTURE LIMITED (GB) 2001-11-27 US disclosed
EP-0811611-B1 2-cyano-1-sulfonamidophenyl-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 2000-01-26 EP disclosed
EP-0674629-B1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE (GB) 1998-07-08 EP disclosed
EP-0811611-A1 2-cyano-1-sulfonamidophenyl-1,3-dione derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1997-12-10 EP disclosed
EP-0674629-A1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1995-10-04 EP disclosed
EP-0625505-A2 2-Cyano-1,3-dione derivatives and their use as herbicides RHONE POULENC AGRICULTURE LTD. (GB) 1994-11-23 EP disclosed
WO-1994014782-A1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1994-07-07 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020045551-A1 4-benzoyl isoxazoles derivatives and their use as herbicides CBR3, CBR1, GLRA3 ACLY 611/4885KMT2A 3499/4885LMNA 2378/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.