SCHEMBL3340907

SCHEMBL3340907

CC(C)(C)c1csc(NNC(=O)c2ccc(Cl)cc2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 1.00
NPC1 O15118 7/20 1.00
TDP1 Q9NUW8 2/20 1.00
MAPT P10636 5/20 0.77
HTT P42858 4/20 0.77
MAPK1 P28482 3/20 0.77
GAA P10253 3/20 0.77
SMN1; SMN2 Q16637 2/20 0.77
TAS1R3 Q7RTX0 1/20 0.55
TAS1R1 Q7RTX1 1/20 0.55
TAS1R2 Q8TE23 1/20 0.55
FFAR2 O15552 1/20 0.54
POLB P06746 1/20 0.52
RAB9A P51151 6/20 0.52
LMNA P02545 5/20 0.52
NPSR1 Q6W5P4 3/20 0.52
HSD17B10 Q99714 2/20 0.52
TLR7 Q9NYK1 1/20 0.50
CA12 O43570 1/20 0.49
CA9 Q16790 1/20 0.49

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
SCHEMBL20791859 0.86 NPC1 (0.76) KDM4ENPC1TDP1MAPTHTT
SCHEMBL3338748 0.75 MAPT (0.82) KDM4ENPC1TDP1MAPTHTT
SCHEMBL20791858 0.75 SMN1; SMN2 (0.77) KDM4ENPC1TDP1MAPTHTT
SCHEMBL77958 0.75 SMN1; SMN2 (0.77) KDM4ENPC1TDP1MAPTHTT
SCHEMBL22103784 0.75 RAB9A (0.76) KDM4ENPC1TDP1MAPTHTT
SCHEMBL78768 0.74 FFAR2 (0.60) KDM4ENPC1TDP1MAPTHTT
SCHEMBL3340070 0.73 MAPT (0.78) KDM4ENPC1TDP1MAPTHTT
SCHEMBL3340134 0.73 MAPT (0.78) KDM4ENPC1TDP1MAPTHTT
SCHEMBL21708002 0.73 CCR4 (0.71) KDM4ENPC1TDP1MAPTMAPK1
SCHEMBL3338655 0.73 MAPT (0.82) KDM4ENPC1TDP1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100151064-A1 THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES TECHNISCHE UNIVERSITAT DARMSTADT (DE) 2010-06-17 US claimed
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
WO-2008052804-A1 THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2008-05-08 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-20100151064-A1 THIAZOLHYDRAZIDES FOR TREATMENT OF NEURODEGENERATIVE DISEASES HTT, MAPT, SNCA KDM4E 4489/4885NPC1 36/4885TDP1 116/4885

“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.