SCHEMBL4329397

SCHEMBL4329397

CN(C)[C@@H]1CCN(c2cc(N3CCC(Cc4ccccc4)CC3)c(F)cc2/C=N/NC(N)=S)C1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.39
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GFER P55789 1/20 0.39
MAOB P27338 1/20 0.39
ACHE P22303 3/20 0.37
ALDH1A1 P00352 4/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
MYC P01106 1/20 0.34

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
SCHEMBL4329400 1.00 MAPT (0.39) MAPTHTTSMN1; SMN2GFERMAOB
SCHEMBL4338700 0.97 MAOB (0.39) MAPTHTTSMN1; SMN2GFERMAOB
SCHEMBL4338705 0.97 MAOB (0.39) MAPTHTTSMN1; SMN2GFERMAOB
SCHEMBL4341429 0.93 LPL (0.37) MAPTHTTSMN1; SMN2GFERMAOB
SCHEMBL4341427 0.93 LPL (0.37) MAPTHTTSMN1; SMN2GFERMAOB
SCHEMBL13612095 0.89 L3MBTL1 (0.42) MAOBALDH1A1GAALMNARAB9A
SCHEMBL4331693 0.88 MAOB (0.41) MAPTSMN1; SMN2GFERMAOBALDH1A1
SCHEMBL4331695 0.88 MAOB (0.41) MAPTSMN1; SMN2GFERMAOBALDH1A1
SCHEMBL4333914 0.87 MAOB (0.40) MAPTSMN1; SMN2MAOBALDH1A1GAA
SCHEMBL4333920 0.87 MAOB (0.40) MAPTSMN1; SMN2MAOBALDH1A1GAA

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 5 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-7521062-B2 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-04-21 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 MAPT 3619/4885HTT 2994/4885SMN1; SMN2 4740/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 MAPT 3876/4885HTT 3282/4885SMN1; SMN2 4815/4885

“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.