SCHEMBL13612364

SCHEMBL13612364

Cc1cccc(C2CCN(c3cc(N4CC[C@@H](N(C)C)C4)c(/C=N/NC(N)=S)cc3F)CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
MAPT P10636 6/20 0.39
ALOX12 P18054 3/20 0.39
GAA P10253 3/20 0.39
MAOB P27338 2/20 0.36
AOC3 Q16853 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
PIM1 P11309 1/20 0.34
PIM3 Q86V86 1/20 0.34
PIM2 Q9P1W9 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 2/20 0.33
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MPI P34949 1/20 0.33
MCHR1 Q99705 1/20 0.33
MYC P01106 1/20 0.32

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
SCHEMBL4331058 0.93 MAOB (0.40) ALDH1A1MAPTALOX12GAAMAOB
SCHEMBL4331051 0.93 MAOB (0.40) ALDH1A1MAPTALOX12GAAMAOB
SCHEMBL4333914 0.92 MAOB (0.40) ALDH1A1MAPTGAAMAOBPIM1
SCHEMBL4333920 0.92 MAOB (0.40) ALDH1A1MAPTGAAMAOBPIM1
SCHEMBL4326223 0.91 ALDH1A1 (0.40) ALDH1A1MAPTALOX12GAAMAOB
SCHEMBL4330369 0.91 ALDH1A1 (0.40) ALDH1A1MAPTALOX12GAAMAOB
SCHEMBL4339922 0.91 DRD2 (0.37) ALDH1A1MAOBLMNADRD4
SCHEMBL4339921 0.91 DRD2 (0.37) ALDH1A1MAOBLMNADRD4
SCHEMBL4457797 0.89 ALDH1A1 (0.46) ALDH1A1MAPTALOX12GAAMAOB
SCHEMBL4457794 0.89 ALDH1A1 (0.46) ALDH1A1MAPTALOX12GAAMAOB

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 2 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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2009-11-19 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 (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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 ALDH1A1 1459/4885MAPT 3619/4885ALOX12 1149/4885

“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.