SCHEMBL4334823

SCHEMBL4334823

NC(=S)NN=Cc1ccc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1N1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 7/20 0.46
LMNA P02545 7/20 0.45
MAPT P10636 3/20 0.45
HTT P42858 2/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.45
XBP1 P17861 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALOX12 P18054 1/20 0.45
RECQL P46063 1/20 0.45
TP53 P04637 1/20 0.42
DHFR P00374 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RPS6KB1 P23443 1/20 0.42
AKT1 P31749 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
SCHEMBL4334819 1.00 PHGDH (0.46) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4330997 0.92 LMNA (0.45) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4330994 0.92 LMNA (0.45) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4331981 0.90 LMNA (0.48) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4331984 0.90 LMNA (0.48) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4334844 0.90 LMNA (0.49) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4334847 0.90 LMNA (0.49) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4453705 0.85 LMNA (0.48) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4453707 0.85 LMNA (0.48) PHGDHLMNAMAPTHTTMEN1
SCHEMBL4324347 0.85 LMNA (0.42) PHGDHLMNAMAPTHTTMEN1

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 PHGDH 2500/4885LMNA 4884/4885MAPT 3619/4885
US-20050069555-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 PHGDH 2768/4885LMNA 4885/4885MAPT 3876/4885

“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.