SCHEMBL5048564

SCHEMBL5048564

O=C(O)c1ccc(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UQCRB P14927 2/20 0.71
CA12 O43570 2/20 0.69
CA9 Q16790 2/20 0.69
CA1 P00915 1/20 0.69
CA2 P00918 1/20 0.69
MEN1 O00255 5/20 0.67
KMT2A Q03164 5/20 0.67
POLB P06746 3/20 0.67
MAPT P10636 2/20 0.67
PSMD14 O00487 1/20 0.67
FGB P02675 1/20 0.67
CYP2C9 P11712 1/20 0.67
CYP2C19 P33261 1/20 0.67
CACNA1B Q00975 1/20 0.67
APBA1 Q02410 1/20 0.67
PLEC Q15149 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
GPR55 Q9Y2T6 1/20 0.64
ALDH1A1 P00352 1/20 0.61
PKM P14618 1/20 0.61

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
SCHEMBL893905 0.90 CA12 (0.73) CA12CA9CA1CA2MEN1
SCHEMBL3715141 0.90 CA12 (0.75) CA12CA9CA1CA2MEN1
SCHEMBL13028459 0.88 GFER (0.77) CA12CA9CA1CA2MEN1
SCHEMBL13028457 0.88 WDR5 (0.68) UQCRBCA12CA9CA1CA2
SCHEMBL5047573 0.86 MEN1 (0.70) UQCRBCA12CA9MEN1KMT2A
SCHEMBL10093054 0.85 GPR55 (0.69) UQCRBCA12CA9MEN1KMT2A
SCHEMBL13480185 0.84 KMT2A (0.77) UQCRBCA12CA9CA1CA2
SCHEMBL812677 0.84 KMT2A (0.77) UQCRBCA12CA9CA1CA2
SCHEMBL13028454 0.84 GFER (0.67) CA12CA9CA1CA2POLB
SCHEMBL6296969 0.83 UQCRB (1.00) UQCRBCA12CA9CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240325340-A1 ISOFORM SPECIFIC AGONISTS TARGETING AKT KINASE LANDAUER, STEPHEN PAUL 2024-10-03 US claimed
WO-2023009629-A1 ISOFORM SPECIFIC AGONISTS TARGETING AKT KINASE THOMAS JEFFERSON UNIVERSITY (US) 2023-02-02 WO claimed
US-20240325340-A1 ISOFORM SPECIFIC AGONISTS TARGETING AKT KINASE LANDAUER, STEPHEN PAUL 2024-10-03 US disclosed
WO-2023009629-A1 ISOFORM SPECIFIC AGONISTS TARGETING AKT KINASE THOMAS JEFFERSON UNIVERSITY (US) 2023-02-02 WO disclosed
US-20080146623-A1 INHIBITORS OF HISTONE DEACETYLASE AND PRODRUGS THEREOF METHYLGENE INC. (CA) 2008-06-19 US disclosed
US-RE39850-E1 Aryl amide, -sulfonamide, or -urea derivatives; antiproliferative, antitumor, anticarcinogenic, and/or antimetastasis agents METHYLGENE, INC. (CA) 2007-09-18 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-20240325340-A1 ISOFORM SPECIFIC AGONISTS TARGETING AKT KINASE AKT3, AKT1, AKT2 UQCRB 4711/4885CA12 4842/4885CA9 4848/4885
US-20080146623-A1 INHIBITORS OF HISTONE DEACETYLASE AND PRODRUGS THEREOF HDAC1, HDAC3, HDAC11 UQCRB 4744/4885CA12 1244/4885CA9 612/4885

“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.