SCHEMBL4334681

SCHEMBL4334681

NC(=S)NN=Cc1ccc(N2CCN(C3CCCCC3)CC2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.41
GAA P10253 3/20 0.36
KDM4E B2RXH2 3/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
MAPT P10636 5/20 0.36
GUSB P08236 1/20 0.36
ALDH1A1 P00352 3/20 0.35
ALOX12 P18054 3/20 0.35
LMNA P02545 4/20 0.35
MPI P34949 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL4334676 1.00 MAOB (0.41) MAOBGAAKDM4EL3MBTL1MAPT
SCHEMBL4334854 0.85 MAOB (0.39) MAOBGAAKDM4EL3MBTL1GUSB
SCHEMBL4334848 0.85 MAOB (0.39) MAOBGAAKDM4EL3MBTL1GUSB
SCHEMBL4324424 0.84 MAOB (0.41) MAOBGAAKDM4EL3MBTL1MAPT
SCHEMBL4324418 0.84 MAOB (0.41) MAOBGAAKDM4EL3MBTL1MAPT
SCHEMBL4329547 0.84 MAOB (0.41) MAOBGAAKDM4EL3MBTL1MAPT
SCHEMBL4329550 0.84 MAOB (0.41) MAOBGAAKDM4EL3MBTL1MAPT
SCHEMBL4325601 0.83 MAOB (0.42) MAOBGAAKDM4EL3MBTL1MAPT
SCHEMBL4326252 0.83 MAOB (0.42) MAOBGAAKDM4EL3MBTL1MAPT
SCHEMBL4327470 0.82 MAOB (0.44) MAOBGAAKDM4EALDH1A1LMNA

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 2762/4885GAA 2113/4885KDM4E 3010/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 MAOB 3093/4885GAA 2263/4885KDM4E 2338/4885

“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.