SCHEMBL6078173

SCHEMBL6078173

CO[C@H](C)[C@@H](CS(=O)(=O)Cc1cnc2ccccc2c1)N(O)C=O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.39
EPAS1 Q99814 1/20 0.39
KDM4E B2RXH2 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PDE10A Q9Y233 9/20 0.36
ALPL P05186 1/20 0.36
CYP1A2 P05177 1/20 0.35
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
TRPM5 Q9NZQ8 1/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
MMP2 P08253 1/20 0.34
MMP13 P45452 1/20 0.34
TRPM8 Q7Z2W7 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
SCHEMBL6079545 1.00 HIF1A (0.39) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6399016 0.89 MMP2 (0.40) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6399014 0.89 MMP2 (0.40) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6077244 0.85 HIF1A (0.36) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6981602 0.84 CYP1A2 (0.38) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6399844 0.82 MMP2 (0.40) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6399841 0.82 MMP2 (0.40) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6400023 0.82 MMP2 (0.38) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6402218 0.81 MMP2 (0.39) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2
SCHEMBL6990090 0.81 PDE10A (0.37) HIF1AEPAS1KDM4EKMT2ASMN1; SMN2

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-7038055-B2 Sulfone derivatives and their use in the treatment of autoimmune diseases and allergies SMITHKLINEBEECHAM PLC (GB) 2006-05-02 US disclosed
EP-1448529-B1 SULFONE DERIVATIVES SUITABLE FOR THE TREATMENT OF AUTOIMMUNE DISEASES AND ALLERGIES SMITHKLINE BEECHAM PLC (GB) 2005-07-13 EP disclosed
US-20050070572-A1 Sulfone derivatives and their use in the treatment of autoimmune diseases and allergies SMITHKLINE BEECHAM PLC (GB) 2005-03-31 US disclosed
EP-1448529-A1 SULFONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES AND ALLERGIES SMITHKLINE BEECHAM PLC (GB) 2004-08-25 EP disclosed
WO-2003045922-A1 SULFONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES AND ALLERGIES SMITHKLINE BEECHAM P.L.C. (GB) 2003-06-05 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-20050070572-A1 Sulfone derivatives and their use in the treatment of autoimmune diseases and allergies CD2, SSB, CD22 HIF1A 2438/4885EPAS1 2346/4885KDM4E 3353/4885

“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.