SCHEMBL4338718

SCHEMBL4338718

COc1ccccc1-c1ccc(C=NNC(=S)NCc2ccccn2)o1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HKDC1 Q2TB90 1/20 0.55
MAPT P10636 3/20 0.51
KDM4E B2RXH2 3/20 0.51
ALDH1A1 P00352 6/20 0.48
HPGD P15428 2/20 0.48
LMNA P02545 1/20 0.48
ALOX12 P18054 1/20 0.48
MEN1 O00255 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 1/20 0.46
PHGDH O43175 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ADORA2A P29274 1/20 0.42
ADORA1 P30542 1/20 0.42
TOP2A P11388 1/20 0.42

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
SCHEMBL4338708 1.00 HKDC1 (0.55) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4338706 0.87 HKDC1 (0.58) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4338698 0.87 HKDC1 (0.58) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4330991 0.83 HKDC1 (0.55) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4330987 0.83 HKDC1 (0.55) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4464598 0.82 HKDC1 (0.54) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4329330 0.82 HKDC1 (0.54) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4464609 0.82 HKDC1 (0.54) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4329322 0.82 HKDC1 (0.54) HKDC1MAPTKDM4EALDH1A1HPGD
SCHEMBL4324320 0.79 LMNA (0.56) HKDC1MAPTKDM4EALDH1A1HPGD

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 HKDC1 1857/4885MAPT 3619/4885KDM4E 3010/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 HKDC1 2089/4885MAPT 3876/4885KDM4E 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.