SCHEMBL3337386

SCHEMBL3337386

O=C(NNc1nc(-c2cc3ccccc3oc2=O)cs1)c1ccc(F)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA12 O43570 16/20 1.00
CA9 Q16790 16/20 1.00
GAA P10253 3/20 0.62
MAPT P10636 3/20 0.62
HTT P42858 3/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
LMNA P02545 2/20 0.62
KDM4E B2RXH2 2/20 0.62
ALDH1A1 P00352 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
CSNK2A1 P68400 1/20 0.62
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
NFKB1 P19838 1/20 0.59
MAPK1 P28482 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
MCL1 Q07820 1/20 0.59

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
SCHEMBL3338338 0.90 CA12 (0.88) CA12CA9GAAMAPTHTT
SCHEMBL3341735 0.89 CA12 (0.83) CA12CA9GAAMAPTHTT
SCHEMBL3338725 0.84 CA12 (0.81) CA12CA9GAAMAPTHTT
SCHEMBL3338729 0.84 CA12 (0.75) CA12CA9GAAMAPTHTT
SCHEMBL14204473 0.83 CA12 (0.71) CA12CA9GAAMAPTHTT
SCHEMBL13328318 0.82 CA12 (0.69) CA12CA9GAAMAPTHTT
SCHEMBL24711240 0.80 CA12 (0.81) CA12CA9KDM4EALDH1A1TDP1
SCHEMBL24711242 0.77 CA12 (0.82) CA12CA9GAALMNAKDM4E
SCHEMBL3337628 0.77 CA12 (0.78) CA12CA9GAAMAPTHTT
SCHEMBL3344724 0.77 KDM4E (1.00) CA12CA9GAAMAPTHTT

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 9 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-8410152-B2 Thiazolhydrazides for treatment of neurodegenerative diseases MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E. V. (DE) 2013-04-02 US disclosed
US-8410152-B2 Thiazolhydrazides for treatment of neurodegenerative diseases MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E. V. (DE) 2013-04-02 US disclosed
EP-1918286-B1 Thiazolhydrazides for treatment of neurodegenerative diseases MAX PLANCK GESELLSCHAFT (DE) 2011-12-21 EP disclosed
EP-1918286-B1 Thiazolhydrazides for treatment of neurodegenerative diseases MAX PLANCK GESELLSCHAFT (DE) 2011-12-21 EP disclosed
US-20100151064-A1 THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES TECHNISCHE UNIVERSITAT DARMSTADT (DE) 2010-06-17 US disclosed
US-20100151064-A1 THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES TECHNISCHE UNIVERSITAT DARMSTADT (DE) 2010-06-17 US disclosed
EP-1918286-A1 Thiazolhydrazides for treatment of neurodegenerative diseases MPG Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2008-05-07 EP disclosed
EP-1918286-A1 Thiazolhydrazides for treatment of neurodegenerative diseases MPG Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2008-05-07 EP 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 3189/4885GAA 76/4885

“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.