SCHEMBL4327199

SCHEMBL4327199

CC(c1ccccc1)N1CCN(c2c(F)cc(/C=N/NC(N)=S)cc2F)CC1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.44
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
LMNA P02545 3/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL4327203 1.00 MAOB (0.44) MAOBPOLBCYP2D6LMNAHTT
SCHEMBL4336763 0.88 MAOB (0.45) MAOBPOLBLMNAHTTSMN1; SMN2
SCHEMBL4336759 0.88 MAOB (0.45) MAOBPOLBLMNAHTTSMN1; SMN2
SCHEMBL4333863 0.86 MAOB (0.44) MAOBPOLBLMNAHTTSMN1; SMN2
SCHEMBL4333865 0.86 MAOB (0.44) MAOBPOLBLMNAHTTSMN1; SMN2
SCHEMBL4331949 0.83 KDM4E (0.49) MAOBCYP2D6LMNASMN1; SMN2ALDH1A1
SCHEMBL4331946 0.83 KDM4E (0.49) MAOBCYP2D6LMNASMN1; SMN2ALDH1A1
SCHEMBL4326748 0.83 MAOB (0.46) MAOBPOLBCYP2D6LMNAHTT
SCHEMBL4326753 0.83 MAOB (0.46) MAOBPOLBCYP2D6LMNAHTT
SCHEMBL4333134 0.81 MAOB (0.41) MAOBPOLBLMNAHTTSMN1; SMN2

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 6 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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2009-11-19 US disclosed
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-7521062-B2 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-04-21 US disclosed
US-7521062-B2 Thiosemicarbazones as anti-virals and immunopotentiators NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-04-21 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-20090285849-A1 Thiosemicarbazones as anti-virals and immunopotentiators MAVS, IRF3, HAVCR2 MAOB 2762/4885POLB 3179/4885CYP2D6 2409/4885

“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.