SCHEMBL4894832

SCHEMBL4894832

O=[N+]([O-])c1cnc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATG4B Q9Y4P1 4/20 0.55
KMO O15229 2/20 0.53
MEN1 O00255 7/20 0.52
KMT2A Q03164 7/20 0.52
RAB9A P51151 3/20 0.51
MAPT P10636 3/20 0.51
LMNA P02545 3/20 0.51
HTT P42858 3/20 0.51
ALDH1A1 P00352 2/20 0.51
NPC1 O15118 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
POLB P06746 1/20 0.50
NPSR1 Q6W5P4 1/20 0.47
CDK2 P24941 1/20 0.47
GSK3A P49840 1/20 0.47
GSK3B P49841 1/20 0.47
DYRK1A Q13627 1/20 0.47
HIPK4 Q8NE63 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47
TNF P01375 1/20 0.47

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
SCHEMBL2783467 0.93 MEN1 (0.58) ATG4BKMOMEN1KMT2ARAB9A
SCHEMBL7978716 0.84 STAT3 (0.59) ATG4BKMOMEN1KMT2ARAB9A
SCHEMBL10526102 0.80 MEN1 (0.56) ATG4BMEN1KMT2ARAB9AMAPT
SCHEMBL4892513 0.79 AKT1 (0.47) ATG4BKMOMEN1KMT2ARAB9A
SCHEMBL28579597 0.77 MEN1 (0.63) ATG4BMEN1KMT2ARAB9AMAPT
SCHEMBL8694330 0.76 MEN1 (0.60) ATG4BMEN1KMT2ARAB9AMAPT
SCHEMBL3251168 0.75 MAPT (0.51) KMOMEN1KMT2ARAB9AMAPT
SCHEMBL3252170 0.74 MMP1 (0.48) MEN1KMT2AMAPTLMNAHTT
SCHEMBL29057037 0.74 STAT3 (0.53) ATG4BMEN1KMT2ARAB9AMAPT
SCHEMBL1804664 0.73 MEN1 (0.68) ATG4BMEN1KMT2ARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001090093-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2001-11-29 WO claimed
US-20080033046-A1 Treatment of myocardial infarction with 11HSD1 inhibitors UNIVERSITY OF EDINBURGH (GB) 2008-02-07 US disclosed
WO-2001090093-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2001-11-29 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-20080033046-A1 Treatment of myocardial infarction with 11HSD1 inhibitors HSD11B1, HSD11B2, CYP11B1 ATG4B 1689/4885KMO 947/4885MEN1 2830/4885

“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.