SCHEMBL7682908

SCHEMBL7682908

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.42
KMT2A Q03164 2/20 0.42
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
ACLY P53396 2/20 0.39
KDM4E B2RXH2 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP19A1 P11511 2/20 0.37
MCL1 Q07820 1/20 0.37
TSHR P16473 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
SCHEMBL7691521 0.83 KMT2A (0.64) KMT2APSEN1PSEN2APH1BNCSTN
SCHEMBL6646574 0.82 KMT2A (0.43) KMT2AKDM4EPOLBL3MBTL1TSHR
SCHEMBL7558061 0.82 CSNK2A1 (0.44) KMT2AACLYPOLBL3MBTL1TSHR
SCHEMBL6645451 0.81 KEAP1 (0.48) KEAP1KMT2AKDM4ECES2CES1
SCHEMBL7556650 0.81 TSHR (0.49) KMT2AACLYKDM4EHSD17B10TSHR
SCHEMBL7684663 0.81 LMNA (0.53) KMT2APOLBL3MBTL1TSHRLMNA
SCHEMBL7557135 0.81 KDM4E (0.42) KMT2AKDM4EPOLBL3MBTL1CYP19A1
SCHEMBL7558164 0.81 KMT2A (0.42) KMT2APOLBL3MBTL1CYP19A1TSHR
SCHEMBL7554663 0.80 LMNA (0.44) KEAP1KMT2AKDM4EHSD17B10POLB
SCHEMBL7636060 0.80 KDM4E (0.54) PTGDR2ACLYKDM4ECES2HPGD

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 KEAP1 2267/4885KMT2A 3499/4885PSEN1 4528/4885

“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.