SCHEMBL3248035

SCHEMBL3248035

Cn1nc(-c2ccc(S(=O)(=O)Nc3ncc(CC(=O)O)s3)s2)cc1C(F)(F)F

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
PTGES2 Q9H7Z7 1/20 0.54
POLB P06746 1/20 0.46
ALDH1A1 P00352 1/20 0.45
PKM P14618 1/20 0.38
SCD O00767 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PFKFB3 Q16875 3/20 0.37
HSD11B1 P28845 1/20 0.36
MAPT P10636 2/20 0.36
SCN9A Q15858 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
TYMS P04818 1/20 0.34
PPARG P37231 1/20 0.34
CCKBR P32239 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
SCHEMBL3617632 0.83 GAA (0.58) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL3253964 0.82 GAA (0.55) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL3254954 0.78 PFKFB3 (0.55) L3MBTL1POLBALDH1A1SCDRXFP1
SCHEMBL6697828 0.77 PTGES2 (0.60) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL3473373 0.76 PTGES2 (0.61) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL3473539 0.75 PTGES2 (0.65) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL3475279 0.75 PTGES2 (0.60) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL7097084 0.75 PTGES2 (0.60) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL16502999 0.74 PTGES2 (0.64) GAAL3MBTL1PTGES2POLBALDH1A1
SCHEMBL3472410 0.74 PTGES2 (0.64) GAAL3MBTL1PTGES2POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1461325-B1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2010-05-26 EP claimed
US-20050250776-A1 Inhibitors of 11-beta-hydroxy steriod dehydrogenase type 1 BIOVITRUM AB 2005-11-10 US claimed
EP-1461325-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2004-09-29 EP claimed
US-20030130318-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2003-07-10 US claimed
WO-2003043999-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-05-30 WO claimed
EP-1461325-B1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2010-05-26 EP disclosed
US-7671051-B2 Inhibitors of 11-β-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2010-03-02 US disclosed
US-7094792-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2006-08-22 US disclosed
US-20050250776-A1 Inhibitors of 11-beta-hydroxy steriod dehydrogenase type 1 BIOVITRUM AB 2005-11-10 US disclosed
WO-2004112782-A1 NEW USE V BIOVITRUM AB (SE) 2004-12-29 WO disclosed
US-20030130318-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2003-07-10 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-20050250776-A1 Inhibitors of 11-beta-hydroxy steriod dehydrogenase type 1 HSD11B1, HSD17B1, HSD17B11 GAA 567/4885L3MBTL1 3863/4885PTGES2 1919/4885
US-20030130318-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD3B1 GAA 351/4885L3MBTL1 4282/4885PTGES2 1300/4885

“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.