SCHEMBL5355918

SCHEMBL5355918

CC(C)C(=O)c1cc(S(=O)(=O)O)cs1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.35
MEN1 O00255 6/20 0.35
ATM Q13315 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
FABP3 P05413 1/20 0.34
FABP4 P15090 1/20 0.34
FABP5 Q01469 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL5350221 0.79 MAPT (0.50) KMT2AMEN1ATMTP53MAPT
SCHEMBL5354367 0.78 KMT2A (0.34) KMT2AMEN1ATMFABP3FABP4
SCHEMBL5354363 0.78 KMT2A (0.34) KMT2AMEN1ATMFABP3FABP4
SCHEMBL195427 0.73 DAO (0.61) CES2CES1TP53MAPT
SCHEMBL553786 0.73 CES2 (0.65) CES2CES1TP53MAPTLMNA
SCHEMBL18830907 0.72 CES2 (0.38) CES2CES1TP53MAPTLMNA
SCHEMBL5355903 0.71 KMT2A (0.34) KMT2AMEN1ATMTP53MAPT
SCHEMBL5355911 0.71 KMT2A (0.34) KMT2AMEN1ATMTP53MAPT
SCHEMBL5354012 0.71 GSK3B (0.41) KMT2AMEN1CES2CES1LMNA
SCHEMBL5370380 0.71 KMT2A (0.34) KMT2AMEN1ATMTP53MAPT

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 3783/4885ATM 2347/4885

“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.