SCHEMBL5831079

SCHEMBL5831079

O=S(=O)(Nc1nnc(CCN2CCOCC2)s1)c1ccc(Cl)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
ALDH1A1 P00352 2/20 0.49
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GLS O94925 3/20 0.45
HSD11B1 P28845 1/20 0.42
MEN1 O00255 1/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HTR6 P50406 1/20 0.40
ENPP2 Q13822 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL5830942 0.87 HSD11B1 (0.49) KMT2AALDH1A1MAPK1HSD17B10GLS
SCHEMBL5830894 0.86 KMT2A (0.41) KMT2AALDH1A1GLSHSD11B1MEN1
SCHEMBL5831264 0.82 ALDH1A1 (0.50) KMT2AALDH1A1MAPK1HSD17B10GLS
SCHEMBL5830637 0.82 ALDH1A1 (0.46) KMT2AALDH1A1MAPK1HSD17B10GLS
SCHEMBL5830627 0.82 HSD11B1 (0.52) KMT2AHSD11B1MEN1SMN1; SMN2
SCHEMBL5831634 0.82 KMT2A (0.43) KMT2AALDH1A1MAPK1HSD11B1CNR1
Hydrochloric Acid SCHEMBL3616223 0.80 HSD11B1 (0.52) KMT2AMAPK1HSD11B1MEN1CNR1
SCHEMBL6611686 0.79 CNR1 (0.44) KMT2AALDH1A1MAPK1MEN1CNR1
SCHEMBL6623700 0.77 CNR1 (0.44) KMT2AALDH1A1MAPK1MEN1CNR1
SCHEMBL6930851 0.76 AKT1 (0.44) KMT2AALDH1A1MEN1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics BIOVITRUM AB (SE) 2003-07-10 US 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
EP-1461327-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2004-09-29 EP disclosed
US-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics BIOVITRUM AB (SE) 2003-07-10 US disclosed
WO-2003044000-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-05-30 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-20030130258-A1 Antidiabetic agents; liver disorders; cardiovascular disorders; dietetics CPT1A, HSD11B1, CES1 KMT2A 2980/4885ALDH1A1 63/4885MAPK1 608/4885

“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.