SCHEMBL5831017

SCHEMBL5831017

O=C(Cc1nsc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)n1)N1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 4/20 0.48
HTT P42858 2/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 2/20 0.46
GAA P10253 2/20 0.46
KMT2A Q03164 4/20 0.44
HSD11B1 P28845 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MMP1 P03956 1/20 0.42
MMP13 P45452 1/20 0.42
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
CYP2C9 P11712 1/20 0.40
MAPK1 P28482 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
SCHEMBL5831705 0.89 MAPT (0.52) SMN1; SMN2ALDH1A1LMNAGAAKMT2A
SCHEMBL6621312 0.86 KMT2A (0.41) SMN1; SMN2ALDH1A1HTTKDM4ELMNA
SCHEMBL5391594 0.85 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1HTTKDM4ELMNA
SCHEMBL3613133 0.84 HSD11B1 (0.60) SMN1; SMN2ALDH1A1HTTKDM4ELMNA
SCHEMBL5831281 0.84 KMT2A (0.45) SMN1; SMN2ALDH1A1HTTKDM4ELMNA
SCHEMBL5831621 0.83 GAA (0.50) SMN1; SMN2ALDH1A1HTTKDM4ELMNA
SCHEMBL3248435 0.83 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1HTTKDM4ELMNA
SCHEMBL5830800 0.83 HSD11B1 (0.51) SMN1; SMN2ALDH1A1HTTLMNAGAA
SCHEMBL5830740 0.83 HSD11B1 (0.46) ALDH1A1HTTLMNAGAAKMT2A
SCHEMBL5832372 0.83 TSHR (0.54) ALDH1A1HTTLMNAGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7074788-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2006-07-11 US claimed
WO-2004113310-A1 USE OF AN INHIBITOR OF 11-B-HYDROXYSTEROID DEHYDROGENASE TYPE 1 COMPOUNDS FOR PROMOTING WOUND HEALING BIOVITRUM AB (SE) 2004-12-29 WO claimed
EP-1461327-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2004-09-29 EP claimed
US-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics BIOVITRUM AB (SE) 2003-07-10 US claimed
WO-2003044000-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-05-30 WO claimed
US-7074788-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2006-07-11 US disclosed
WO-2004113310-A1 USE OF AN INHIBITOR OF 11-B-HYDROXYSTEROID DEHYDROGENASE TYPE 1 COMPOUNDS FOR PROMOTING WOUND HEALING BIOVITRUM AB (SE) 2004-12-29 WO disclosed
US-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics 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 (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-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics CPT1A, HSD11B1, CES1 SMN1; SMN2 2532/4885ALDH1A1 63/4885HTT 2548/4885

“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.