SCHEMBL3337733

SCHEMBL3337733

CC(=O)NNc1nc(-c2ccc([N+](=O)[O-])cc2)cs1

nearest known ligand 0.77

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.77
MAPT P10636 12/20 0.68
GAA P10253 7/20 0.68
ALDH1A1 P00352 3/20 0.68
KDM4E B2RXH2 2/20 0.68
NPC1 O15118 2/20 0.67
KMT2A Q03164 5/20 0.67
GFER P55789 3/20 0.67
MEN1 O00255 4/20 0.66
LMNA P02545 4/20 0.66
TDP1 Q9NUW8 2/20 0.66
SMN1; SMN2 Q16637 1/20 0.56
POLB P06746 1/20 0.55
RECQL P46063 1/20 0.55
MAOA P21397 1/20 0.54
MAOB P27338 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
SCHEMBL9621679 0.87 RAB9A (1.00) RAB9AMAPTGAANPC1KMT2A
SCHEMBL10812081 0.81 RAB9A (0.80) RAB9AMAPTGAAALDH1A1NPC1
SCHEMBL10922446 0.81 RAB9A (0.80) RAB9AMAPTGAAALDH1A1NPC1
SCHEMBL3342093 0.81 MAPT (0.72) RAB9AMAPTGAAALDH1A1KDM4E
SCHEMBL3335920 0.81 MAPT (0.71) RAB9AMAPTGAAALDH1A1KDM4E
SCHEMBL13304310 0.81 BAZ1A (0.64) RAB9AMAPTGAAALDH1A1NPC1
SCHEMBL12643697 0.81 MAPT (1.00) RAB9AMAPTGAAALDH1A1NPC1
SCHEMBL10965903 0.80 RAB9A (0.78) RAB9AMAPTGAAALDH1A1NPC1
SCHEMBL10965397 0.80 RAB9A (0.77) RAB9AMAPTGAAALDH1A1NPC1
SCHEMBL3338316 0.79 MAPT (0.74) RAB9AMAPTGAAALDH1A1KDM4E

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 1 patent. 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

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 RAB9A 2591/4885MAPT 2/4885GAA 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.