SCHEMBL1618178

SCHEMBL1618178

O=S(=O)(c1ccccc1)N(C[C@@H]1CO1)C[C@@H]1CO1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.73
KDM4E B2RXH2 4/20 0.57
USP2 O75604 1/20 0.55
ALDH1A1 P00352 5/20 0.54
POLB P06746 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KMT2A Q03164 4/20 0.49
MEN1 O00255 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.46
APOBEC3G Q9HC16 1/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 1/20 0.42
MAPK1 P28482 1/20 0.40
CASP1 P29466 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL2966811 1.00 LMNA (0.73) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL30760509 0.86 LMNA (0.57) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL10547816 0.84 LMNA (0.55) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL30760453 0.81 LMNA (0.51) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL11710533 0.81 MEN1 (0.56) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL5935004 0.81 LMNA (0.51) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL24793061 0.80 LMNA (0.50) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL24793060 0.80 LMNA (0.50) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL4799669 0.80 ALDH1A1 (0.69) LMNAKDM4EUSP2ALDH1A1POLB
SCHEMBL4420917 0.79 LMNA (0.49) LMNAALDH1A1POLBL3MBTL1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928225-B2 Oxabispidine compounds for the treatment of cardiac arrhythmias ASTRAZENECA AB (SE) 2011-04-19 US disclosed
US-20100160626-A1 Process For The Preparation Of 3,7-Dihydroxy-1,5-Diazacyclooctanes ASTRAZENECA AB (SE) 2010-06-24 US disclosed
US-20090054422-A1 New Oxabispidine Compounds For The Treatment Of Cardiac Arrhythmias ASTRAZENECA AB (SE) 2009-02-26 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 (2 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-20090054422-A1 New Oxabispidine Compounds For The Treatment Of Cardiac Arrhythmias RYR1, KCNH1, CACNA1E LMNA 904/4885KDM4E 3729/4885USP2 4320/4885
US-20100160626-A1 Process For The Preparation Of 3,7-Dihydroxy-1,5-Diazacyclooctanes CYP2D6, KCNH1, CYP2B6 LMNA 502/4885KDM4E 1811/4885USP2 4736/4885

“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.