SCHEMBL7679738

SCHEMBL7679738

Cc1ccc(S(=O)(=O)OC[C@@H]2COc3ccc4c(c3O2)OCO4)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
CYP3A4 P08684 3/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP2D6 P10635 2/20 0.39
TSHR P16473 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPK1 P28482 1/20 0.39
CA2 P00918 1/20 0.38
HSP90AA1 P07900 2/20 0.36
HSP90AB1 P08238 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34

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
SCHEMBL6983946 0.86 LMNA (0.41) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL1873064 0.86 LMNA (0.41) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL7676015 0.86 LMNA (0.42) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL8103835 0.85 LMNA (0.46) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL7781985 0.85 LMNA (0.46) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
Hydrochloric Acid SCHEMBL6764944 0.85 LMNA (0.41) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL7782073 0.84 LMNA (0.48) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL6976439 0.84 LMNA (0.48) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL6976444 0.84 LMNA (0.48) LMNASMN1; SMN2CYP3A4MAPTALDH1A1
SCHEMBL6746121 0.84 LMNA (0.41) LMNASMN1; SMN2CYP3A4MAPTALDH1A1

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-6353002-B2 DIOXINOINDOLE AND THIENOBENZODIOXIN COMPOUNDS WHICH ARE HT3 RECEPTOR ANTAGONISTS AND ARE USED TO TREAT CENTRAL NERVOUS SYSTEM DISORDERS KNOLL AKTIENGESELLSCHAFT (DE) 2002-03-05 US disclosed
US-20010008903-A1 Therapeutic agents BIRCH ALAN MARTIN (GB) 2001-07-19 US disclosed
US-6201004-B1 CENTRAL NERVOUS SYSTEM, PSYCHOLOGICAL, EATING, CARDIOVASCULAR, BRAIN, AND GASTROINTESTINAL DISORDERS KNOLL AKTIENGESELLSCHAFT (DE) 2001-03-13 US disclosed
EP-0966470-A1 DIOXINO DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS KNOLL AKTIENGESELLSCHAFT (DE) 1999-12-29 EP disclosed
WO-1998040386-A1 DIOXINO DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS KNOLL AKTIENGESELLSCHAFT (DE) 1998-09-17 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-20010008903-A1 Therapeutic agents GPR119, SNCA, HTR2B LMNA 4574/4885SMN1; SMN2 564/4885CYP3A4 1668/4885

“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.