SCHEMBL5370926

SCHEMBL5370926

COc1ccc2[nH]c(S)nc2c1S(=O)(=O)c1ccc(OCC(N)=O)c(OCC(N)=O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.40
POLB P06746 2/20 0.38
TSHR P16473 2/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 5/20 0.37
GAA P10253 2/20 0.37
PDE10A Q9Y233 1/20 0.35
PLAU P00749 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
HSD17B10 Q99714 1/20 0.35
NAMPT P43490 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
SCHEMBL5359143 0.89 ACACA (0.38) POLBMAPK1ALDH1A1GAAPDE10A
SCHEMBL5362123 0.85 PTGER3 (0.37) SNCAPOLBTSHRMAPK1ALDH1A1
SCHEMBL5370935 0.84 SNCA (0.40) SNCAPOLBTSHRMAPK1ALDH1A1
SCHEMBL5358476 0.77 BRS3 (0.49) POLBALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL5362138 0.75 SNCA (0.36) SNCAPOLBTSHRMAPK1ALDH1A1
SCHEMBL5377792 0.74 PPARD (0.39) POLBTSHRGAA
SCHEMBL5370447 0.74 DGAT1 (0.37) MAPK1ALDH1A1GAAMEN1KMT2A
SCHEMBL5378206 0.73 LMNA (0.37) POLBALDH1A1GAAMEN1KMT2A
SCHEMBL5359154 0.73 PDE10A (0.40) POLBMAPK1ALDH1A1GAAPDE10A
SCHEMBL5726542 0.71 KMT2A (0.34) POLBTSHRMAPK1ALDH1A1GAA

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-7294716-B2 Process for preparing isomerically pure prodrugs of proton pump inhibitors ALLERGAN, INC. (US) 2007-11-13 US disclosed
US-20050038076-A1 Process for preparing isomerically pure prodrugs of proton pump inhibitors ALEVIUM PHARMACEUTICALS, INC. 2005-02-17 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-20050038076-A1 Process for preparing isomerically pure prodrugs of proton pump inhibitors SI, ATP6AP1, HRH2 SNCA 3558/4885POLB 1255/4885TSHR 2081/4885

“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.