SCHEMBL5832041

SCHEMBL5832041

CC(=O)Nc1ccc(-c2nnc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)s2)cc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.66
PKM P14618 1/20 0.66
AKT1 P31749 2/20 0.63
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
CA9 Q16790 1/20 0.63
MEN1 O00255 4/20 0.62
KMT2A Q03164 4/20 0.62
LMNA P02545 1/20 0.62
ALOX12 P18054 1/20 0.62
HTT P42858 1/20 0.62
GAA P10253 2/20 0.59
MAPT P10636 1/20 0.59
MAPK1 P28482 1/20 0.59
HSD17B10 Q99714 1/20 0.57
GFER P55789 1/20 0.55
USP2 O75604 2/20 0.55
USP8 P40818 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL5830937 0.86 MEN1 (0.81) ALDH1A1PKMCA1CA2CA9
SCHEMBL5832153 0.85 AKT1 (0.65) ALDH1A1PKMAKT1CA1CA2
SCHEMBL328514 0.81 ALDH1A1 (0.68) ALDH1A1PKMAKT1CA1CA2
SCHEMBL5831179 0.81 ATM (0.65) ALDH1A1PKMAKT1CA1CA2
SCHEMBL286629 0.80 ALDH1A1 (0.71) ALDH1A1PKMAKT1CA1CA2
SCHEMBL634004 0.80 MEN1 (0.75) CA1CA2CA9MEN1KMT2A
SCHEMBL286763 0.80 ALDH1A1 (1.00) ALDH1A1PKMAKT1CA1CA2
SCHEMBL5831270 0.80 USP36 (0.62) ALDH1A1PKMAKT1MEN1KMT2A
SCHEMBL2762864 0.80 MAPT (0.77) ALDH1A1PKMMEN1KMT2ALMNA
SCHEMBL28568674 0.79 RXFP1 (0.62) ALDH1A1MEN1KMT2ALMNAHTT

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
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
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 ALDH1A1 63/4885PKM 628/4885AKT1 2974/4885

“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.