SCHEMBL13612399

SCHEMBL13612399

CCNC(=S)N/N=C/[C@@H]1CCCN1Cc1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
CCR2 P41597 3/20 0.39
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 2/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GAA P10253 1/20 0.37
ALOX12 P18054 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL4325060 1.00 SMN1; SMN2 (0.43) SMN1; SMN2NPC1RAB9ATAAR1CCR2
SCHEMBL4338699 0.86 ALDH1A1 (0.39) SMN1; SMN2NPC1RAB9ACCR2LMNA
SCHEMBL13612259 0.86 ALDH1A1 (0.39) SMN1; SMN2NPC1RAB9ACCR2LMNA
SCHEMBL4330378 0.84 GAA (0.40) SMN1; SMN2CCR2MAPTGAAALOX12
SCHEMBL4330375 0.84 GAA (0.40) SMN1; SMN2CCR2MAPTGAAALOX12
SCHEMBL4332941 0.82 MAPT (0.57) SMN1; SMN2NPSR1LMNAMAPTTDP1
SCHEMBL4332935 0.82 MAPT (0.57) SMN1; SMN2NPSR1LMNAMAPTTDP1
SCHEMBL4331355 0.82 GAA (0.44) SMN1; SMN2NPC1RAB9ANPSR1LMNA
SCHEMBL4331347 0.82 GAA (0.44) SMN1; SMN2NPC1RAB9ANPSR1LMNA
SCHEMBL4326601 0.81 ALDH1A1 (0.38) SMN1; SMN2CCR2LMNAMAPTGAA

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 4 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-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 SMN1; SMN2 4740/4885NPC1 1680/4885RAB9A 2667/4885

“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.