SCHEMBL19274657

SCHEMBL19274657

CSc1ccc(Sc2cnc(CNC(=O)OC(C)(C)C)s2)cc1-c1cnn(C)c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IRAK1 P51617 2/20 0.39
GSK3B P49841 2/20 0.39
DYRK1A Q13627 2/20 0.39
PDPK1 O15530 1/20 0.38
MET P08581 9/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
PRMT5 O14744 2/20 0.37
WDR77 Q9BQA1 2/20 0.37
RET P07949 1/20 0.35
LOXL2 Q9Y4K0 2/20 0.34
WNT1 P04628 1/20 0.34
PCSK9 Q8NBP7 1/20 0.33

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
SCHEMBL19274739 0.89 LOXL2 (0.46) IRAK1GSK3BDYRK1APDPK1MET
SCHEMBL19259596 0.88 PCSK9 (0.36) IRAK1LOXL2PCSK9
SCHEMBL19274478 0.86 PDPK1 (0.42) DYRK1APDPK1
SCHEMBL29970064 0.85 IRAK1 (0.46) IRAK1GSK3BDYRK1APDPK1MET
SCHEMBL19274598 0.85 IRAK1 (0.46) IRAK1GSK3BDYRK1APDPK1MET
SCHEMBL20983582 0.81 LOXL2 (0.38) LOXL2
SCHEMBL19274642 0.81 LOXL2 (0.42) IRAK1GSK3BDYRK1APDPK1MET
SCHEMBL19274863 0.80 PDPK1 (0.41) DYRK1APDPK1LOXL2
SCHEMBL19274725 0.80 LOXL2 (0.43) IRAK1GSK3BDYRK1APDPK1MET
SCHEMBL19274609 0.80 LOXL2 (0.44) IRAK1GSK3BDYRK1APDPK1MET

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
US-11608330-B2 Methylamine derivatives as lysysl oxidase inhibitors for the treatment of cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2023-03-21 US disclosed
US-20220372028-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2022-11-24 US disclosed
US-10995088-B2 Methylamine derivatives as lysysl oxidase inhibitors for the treatment of cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-05-04 US disclosed
US-20210040078-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-02-11 US disclosed
US-10807974-B2 Methylamine derivatives as lysysl oxidase inhibitors for the treatment of cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-10-20 US disclosed
US-20190152966-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2019-05-23 US disclosed
WO-2017141049-A1 METHYLAMINE DERIVATIVES AS LYSYSL OXIDASE INHIBITORS FOR THE TREATMENT OF CANCER THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2017-08-24 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 (6 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-20190152966-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer LOXL1, LOXL3, LOXL2 IRAK1 983/4885GSK3B 921/4885DYRK1A 409/4885
US-20210040078-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer LOXL1, LOXL3, LOXL2 IRAK1 983/4885GSK3B 921/4885DYRK1A 409/4885
US-20220372028-A1 Methylamine Derivatives as Lysysl Oxidase Inhibitors for the Treatment of Cancer LOXL1, LOXL3, LOXL2 IRAK1 983/4885GSK3B 921/4885DYRK1A 409/4885
US-10995088-B2 Methylamine derivatives as lysysl oxidase inhibitors for the treatment of cancer LOXL1, LOXL3, LOXL2 IRAK1 983/4885GSK3B 921/4885DYRK1A 409/4885
US-10807974-B2 Methylamine derivatives as lysysl oxidase inhibitors for the treatment of cancer LOXL1, LOXL3, LOXL2 IRAK1 983/4885GSK3B 921/4885DYRK1A 409/4885
US-11608330-B2 Methylamine derivatives as lysysl oxidase inhibitors for the treatment of cancer LOXL1, LOXL3, LOXL2 IRAK1 983/4885GSK3B 921/4885DYRK1A 409/4885

“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.