SCHEMBL4476640

SCHEMBL4476640

O=C(O)COCCNCS(=O)(=O)c1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RAB9A P51151 2/20 0.40
PTGES O14684 1/20 0.38
MMP7 P09237 1/20 0.37
KAT6A Q92794 1/20 0.37
HSD11B1 P28845 1/20 0.36
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SLC22A12 Q96S37 2/20 0.36
ALKBH2 Q6NS38 1/20 0.35
ALKBH3 Q96Q83 1/20 0.35
FTO Q9C0B1 1/20 0.35
NAMPT P43490 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4467178 0.82 EPHX2 (0.40) GAA
SCHEMBL5114277 0.81 ALDH1A1 (0.40) ALDH1A1KMT2AKDM4EHTTSMN1; SMN2
SCHEMBL5128116 0.79 ALDH1A1 (0.49) ALDH1A1KMT2AMMP7HSD11B1TDP1
SCHEMBL5124830 0.78 LMNA (0.39) ALDH1A1RAB9AKAT6AHSD11B1GAA
SCHEMBL5125393 0.77 KMT2A (0.39) ALDH1A1KMT2AHTTTDP1
SCHEMBL5121522 0.74 TBXA2R (0.41) KAT6ASMN1; SMN2
SCHEMBL4476644 0.73 BDKRB1 (0.56) ALDH1A1MEN1KMT2ARAB9AHSD11B1
SCHEMBL493498 0.73 TBXA2R (0.46) ALDH1A1MEN1KMT2AHSD11B1
SCHEMBL5132109 0.72 MEP1B (0.43) GAAKDM4ESMN1; SMN2
SCHEMBL493617 0.72 KMT2A (0.42) ALDH1A1KMT2AGAAMAPK1

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-7538111-B2 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2009-05-26 US disclosed
US-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2006-08-10 US 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-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LTB4R2, BDKRB2, TBXA2R ALDH1A1 283/4885MEN1 4881/4885KMT2A 4041/4885

“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.