SCHEMBL5358758

SCHEMBL5358758

COCOC(CN(C)S(=O)(=O)c1ccsc1NC(=O)OC(C)(C)C)c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KCNQ4 P56696 1/20 0.32
KCNQ5 Q9NR82 1/20 0.32
CCR5 P51681 1/20 0.31
AOC3 Q16853 1/20 0.31
RORC P51449 4/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CTSS P25774 1/20 0.30
CTSK P43235 1/20 0.30

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
SCHEMBL5349661 0.85 AOC3 (0.38) MAPTSMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL5358149 0.85 RORC (0.33) KCNQ4KCNQ5CCR5RORC
SCHEMBL5348107 0.84 TP53 (0.31) KCNQ4KCNQ5RORC
SCHEMBL5358989 0.83 LMNA (0.44) MAPTSMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL5358765 0.82 SMN1; SMN2 (0.34) MAPTSMN1; SMN2LMNARORC
SCHEMBL5352376 0.82 LMNA (0.38) MAPTSMN1; SMN2LMNAALDH1A1CYP1A2
SCHEMBL5352919 0.81 CCR5 (0.32) ALDH1A1KCNQ4KCNQ5CCR5RORC
SCHEMBL5359283 0.81 BACE1 (0.34) ALDH1A1CYP2C19CCR5RORCKMT2A
SCHEMBL5349250 0.77 KCNQ4 (0.39) MAPTSMN1; SMN2LMNACYP2C19KCNQ4
SCHEMBL5353058 0.71 AOC3 (0.36) KCNQ4KCNQ5CCR5AOC3RORC

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 MAPT 4554/4885SMN1; SMN2 4036/4885LMNA 4744/4885

“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.