SCHEMBL4334459

SCHEMBL4334459

NC(=S)NN=CC1CCCCN1Cc1ccc(Cl)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.41
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPBWR1 P48145 1/20 0.38
MCHR1 Q99705 1/20 0.38
SIGMAR1 Q99720 6/20 0.38
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 2/20 0.37
LMNA P02545 1/20 0.37
ALOX12 P18054 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL4334453 1.00 TYR (0.41) TYRPOLBSMN1; SMN2NPBWR1MCHR1
SCHEMBL4334450 1.00 TYR (0.41) TYRPOLBSMN1; SMN2NPBWR1MCHR1
SCHEMBL4326605 0.89 ALDH1A1 (0.38) SMN1; SMN2NPBWR1MCHR1ALDH1A1MAPT
SCHEMBL4326601 0.89 ALDH1A1 (0.38) SMN1; SMN2NPBWR1MCHR1ALDH1A1MAPT
SCHEMBL4329562 0.87 ALDH1A1 (0.45) SMN1; SMN2NPBWR1MCHR1SIGMAR1ALDH1A1
SCHEMBL4329569 0.87 ALDH1A1 (0.45) SMN1; SMN2NPBWR1MCHR1SIGMAR1ALDH1A1
SCHEMBL4329557 0.87 ALDH1A1 (0.45) SMN1; SMN2NPBWR1MCHR1SIGMAR1ALDH1A1
SCHEMBL4330378 0.85 GAA (0.40) SMN1; SMN2ALDH1A1MAPTALOX12
SCHEMBL4330375 0.85 GAA (0.40) SMN1; SMN2ALDH1A1MAPTALOX12
SCHEMBL4333024 0.84 GPBAR1 (0.41) ALDH1A1MAPTHPGDHTTLMNA

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 TYR 1808/4885POLB 3179/4885SMN1; SMN2 4740/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 TYR 2113/4885POLB 3934/4885SMN1; 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.