SCHEMBL4464604

SCHEMBL4464604

NC(=S)N(Cc1ccccn1)N=Cc1ccc(-c2ccc(F)cc2F)o1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
SLC9A1 P19634 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
CHRNA7 P36544 4/20 0.34
PDE4B Q07343 1/20 0.34
PIK3CG P48736 1/20 0.34
MGAM O43451 2/20 0.33
GAA P10253 2/20 0.33
SI P14410 2/20 0.33
MGAM2 Q2M2H8 2/20 0.33

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
SCHEMBL4329325 0.93 SLC9A1 (0.36) MAPTMEN1KMT2ASLC9A1ALDH1A1
SCHEMBL4322273 0.86 MAPT (0.38) MAPTMEN1KMT2ASLC9A1ALDH1A1
SCHEMBL4331899 0.86 LMNA (0.37) MAPTMEN1KMT2ASLC9A1ALDH1A1
SCHEMBL4338702 0.83 NPFFR1 (0.50) MAPTMEN1KMT2AATMSLC9A1
SCHEMBL4338712 0.82 MAPT (0.51) MAPTMEN1KMT2ASLC9A1ALDH1A1
SCHEMBL4330988 0.82 NPFFR1 (0.53) MAPTMEN1KMT2ASLC9A1ALDH1A1
SCHEMBL4324316 0.79 MAPT (0.38) MAPTMEN1KMT2ASLC9A1ALDH1A1
SCHEMBL4451555 0.78 KDM4E (0.50) MAPTMEN1KMT2ASLC9A1ALDH1A1
SCHEMBL4464598 0.76 HKDC1 (0.54) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL4464609 0.76 HKDC1 (0.54) MAPTMEN1KMT2AALDH1A1LMNA

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-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 (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-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 TP53 838/4885MAPT 3876/4885MEN1 4872/4885

“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.