SCHEMBL3338729

SCHEMBL3338729

O=C(NNc1nc(-c2cc3ccccc3oc2=O)cs1)c1ccc2c(c1)OCO2

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 16/20 0.75
CA9 Q16790 16/20 0.75
CDC25A P30304 1/20 0.61
CDC25B P30305 1/20 0.61
CDC25C P30307 1/20 0.61
DUSP3 P51452 1/20 0.61
CSNK2A1 P68400 1/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
NFKB1 P19838 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
NFKB2 Q00653 1/20 0.55
RELA Q04206 1/20 0.55
MCL1 Q07820 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
KDM4E B2RXH2 1/20 0.54

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
SCHEMBL3341735 0.87 CA12 (0.83) CA12CA9CSNK2A1MEN1KMT2A
SCHEMBL3338338 0.84 CA12 (0.88) CA12CA9CSNK2A1MEN1KMT2A
SCHEMBL3337386 0.84 CA12 (1.00) CA12CA9CSNK2A1MEN1KMT2A
SCHEMBL3338101 0.81 MAPT (0.67) MEN1KMT2ALMNAGAAMAPT
SCHEMBL3338725 0.80 CA12 (0.81) CA12CA9CSNK2A1MEN1KMT2A
SCHEMBL4304956 0.76 CDC25A (1.00) CA12CA9CDC25ACDC25BCDC25C
SCHEMBL3341872 0.76 MAPT (0.61) CA12CA9MEN1KMT2ALMNA
SCHEMBL3339186 0.75 NPC1 (0.78) MEN1KMT2ALMNAGAAMAPT
SCHEMBL24711240 0.74 CA12 (0.81) CA12CA9CSNK2A1MEN1KMT2A
SCHEMBL3337373 0.74 PTGS2 (0.64) CA12CA9CSNK2A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8410152-B2 Thiazolhydrazides for treatment of neurodegenerative diseases MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E. V. (DE) 2013-04-02 US disclosed
US-20100151064-A1 THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES TECHNISCHE UNIVERSITAT DARMSTADT (DE) 2010-06-17 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-20100151064-A1 THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES HTT, MAPT, SNCA CA12 3769/4885CA9 3189/4885CDC25A 4288/4885

“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.