SCHEMBL5146331

SCHEMBL5146331

CC(=O)c1ccc(Nc2snnc2C(N)=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ILK Q13418 3/20 0.69
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 4/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
POLB P06746 2/20 0.44
TP53 P04637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
AURKA O14965 1/20 0.42
CCNA2 P20248 1/20 0.42
CDK2 P24941 1/20 0.42
PLK1 P53350 1/20 0.42
CCNA1 P78396 1/20 0.42
PTGS2 P35354 2/20 0.40
ALOX5 P09917 1/20 0.40

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
SCHEMBL5149415 0.85 ILK (0.73) ILKNPC1RAB9AMAPTHTT
SCHEMBL5146289 0.82 ILK (0.73) ILKRAB9AMAPTHTTALDH1A1
SCHEMBL5147602 0.82 ILK (1.00) ILKMAPTHTTALDH1A1SMN1; SMN2
SCHEMBL5149440 0.82 ILK (0.68) ILKNPC1RAB9AMAPTHTT
SCHEMBL5147711 0.79 ILK (0.68) ILKMAPTHTTALDH1A1POLB
SCHEMBL5149886 0.79 ILK (0.63) ILKNPC1RAB9AMAPTHTT
SCHEMBL5146290 0.78 ILK (0.66) ILKRAB9AMAPTALDH1A1POLB
SCHEMBL5147927 0.77 ILK (0.77) ILKNPC1RAB9AMAPTHTT
SCHEMBL5147923 0.77 ILK (0.77) ILKNPC1RAB9AMAPTHTT
SCHEMBL5146356 0.76 ILK (0.63) ILKMAPTHTTALDH1A1NPSR1

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-7288556-B2 Antiproliferative 1,2,3-thiadiazole compounds QLT INC. (CA) 2007-10-30 US disclosed
US-7022702-B2 Antiproliferative 1,2,3-thiadiazole compounds QLT INC. (CA) 2006-04-04 US disclosed
US-20060009500-A1 Antiproliferative 1,2,3-thiadiazole compounds QLT INC. (CA) 2006-01-12 US disclosed
US-20030096848-A1 Antiproliferative 1,2,3-thiadiazole compounds DERMIRA (CANADA), INC. 2003-05-22 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-20030096848-A1 Antiproliferative 1,2,3-thiadiazole compounds CCNA1, CCND1, CCND3 ILK 1286/4885NPC1 1087/4885RAB9A 4479/4885
US-20060009500-A1 Antiproliferative 1,2,3-thiadiazole compounds CCNA1, CCND3, ACIN1 ILK 2862/4885NPC1 2599/4885RAB9A 3543/4885

“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.