SCHEMBL7684663

SCHEMBL7684663

CN(c1cc(S(C)(=O)=O)ccc1C(=O)O)S(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.53
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.38
AKR1C3 P42330 2/20 0.38
AKR1C2 P52895 2/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL7867134 0.83 KMT2A (0.64) LMNAKMT2APOLBL3MBTL1TSHR
SCHEMBL7558061 0.82 CSNK2A1 (0.44) KMT2APOLBL3MBTL1TSHR
SCHEMBL6646574 0.82 KMT2A (0.43) KMT2APOLBL3MBTL1TSHR
SCHEMBL7557135 0.81 KDM4E (0.42) KMT2AAKR1C3AKR1C2POLBL3MBTL1
SCHEMBL7682908 0.81 KEAP1 (0.42) LMNAKMT2APOLBL3MBTL1TSHR
SCHEMBL7558164 0.81 KMT2A (0.42) LMNAKMT2APOLBL3MBTL1TSHR
SCHEMBL7556650 0.81 TSHR (0.49) LMNAKMT2ATSHRSMN1; SMN2
SCHEMBL7558215 0.80 LMNA (0.49) LMNAKMT2AAKR1C3AKR1C2TSHR
SCHEMBL30005767 0.79 KMT2A (0.48) LMNAKMT2ATDP1AKR1C3AKR1C2
SCHEMBL8634139 0.79 KMT2A (0.41) LMNAKMT2APOLBL3MBTL1TSHR

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 5 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
US-6323155-B1 EXCELLENT LEVEL OF HERBICIDAL ACTIVITY TOGETHER WITH CROP TOLERANCE RHONE-POULENC AGRICULTURE LIMITED (GB) 2001-11-27 US disclosed
EP-0674629-B1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE POULENC AGRICULTURE (GB) 1998-07-08 EP disclosed
EP-0674629-A1 4-BENZOYL ISOXAZOLES DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1995-10-04 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 LMNA 2378/4885KMT2A 3499/4885TDP1 3649/4885

“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.