SCHEMBL4333865

SCHEMBL4333865

CC(C)N1CCN(c2c(F)cc(C=NNC(N)=S)cc2F)CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.44
KDM4E B2RXH2 2/20 0.42
POLB P06746 1/20 0.42
GAA P10253 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
HTT P42858 1/20 0.39
MAOA P21397 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL4333863 1.00 MAOB (0.44) MAOBKDM4EPOLBGAASMN1; SMN2
SCHEMBL4333134 0.87 MAOB (0.41) MAOBKDM4EPOLBGAASMN1; SMN2
SCHEMBL4333137 0.87 MAOB (0.41) MAOBKDM4EPOLBGAASMN1; SMN2
SCHEMBL4336633 0.86 MAOB (0.47) MAOBKDM4EPOLBGAASMN1; SMN2
SCHEMBL4336631 0.86 MAOB (0.47) MAOBKDM4EPOLBGAASMN1; SMN2
SCHEMBL4327199 0.86 MAOB (0.44) MAOBKDM4EPOLBGAASMN1; SMN2
SCHEMBL4327203 0.86 MAOB (0.44) MAOBKDM4EPOLBGAASMN1; SMN2
SCHEMBL4329897 0.79 MAOB (0.42) MAOBKDM4EPOLBLMNARAB9A
SCHEMBL4329900 0.79 MAOB (0.42) MAOBKDM4EPOLBLMNARAB9A
SCHEMBL4331694 0.79 MAOB (0.40) MAOBKDM4EPOLBGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2009-11-19 US disclosed
US-7521062-B2 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-04-21 US disclosed
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2005-03-31 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 (2 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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 MAOB 2762/4885KDM4E 3010/4885POLB 3179/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 MAOB 3093/4885KDM4E 2338/4885POLB 3934/4885

“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.