SCHEMBL5356409

SCHEMBL5356409

CN(CC(O)c1ccc(F)cc1)S(=O)(=O)c1ccc(Br)s1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.56
MEN1 O00255 4/20 0.47
AOC3 Q16853 1/20 0.47
ALDH1A1 P00352 4/20 0.46
TSHR P16473 2/20 0.46
HPGD P15428 1/20 0.46
MAPT P10636 4/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 2/20 0.43
GAA P10253 2/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 1/20 0.41
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL5353441 0.83 AOC3 (0.45) KMT2AMEN1AOC3ALDH1A1TSHR
SCHEMBL5354321 0.83 KMT2A (0.51) KMT2AMEN1AOC3ALDH1A1TSHR
SCHEMBL27827026 0.80 KMT2A (0.57) KMT2AMEN1ALDH1A1TSHRHPGD
SCHEMBL5350246 0.79 KMT2A (0.66) KMT2AMEN1ALDH1A1TSHRHPGD
SCHEMBL5357154 0.72 AOC3 (0.36) KMT2AAOC3
SCHEMBL5353058 0.71 AOC3 (0.36) KMT2AAOC3TP53
SCHEMBL16001665 0.71 ALDH1A1 (0.54) KMT2AMEN1ALDH1A1TSHRHPGD
SCHEMBL5351435 0.71 AOC3 (0.38) KMT2AAOC3
SCHEMBL5361944 0.71 AOC3 (0.45) KMT2AMEN1AOC3TSHRHPGD
SCHEMBL25244960 0.71 KMT2A (0.43) KMT2AMEN1ALDH1A1TSHRHPGD

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-7217723-B2 Substituted benzothiophenes, e.g., 7Z)-7-hydroxyimino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-sulfonic acid [2-(4-fluorophenyl)-2-hydroxyethyl]-methyl-amide; treating allergies such as atopic dermatitis, allergic coryza, bronchial asthma, hypersensitive pneumoniac and pulmonary aspergillosis. EISAI CO., LTD. (JP) 2007-05-15 US disclosed
US-20050227959-A1 Heterocyclic compound having oxime group EISAI CO., LTD. (JP) 2005-10-13 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-20050227959-A1 Heterocyclic compound having oxime group STAT6, HRH4, HRH2 KMT2A 649/4885MEN1 3783/4885AOC3 522/4885

“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.