SCHEMBL5568413

SCHEMBL5568413

O=C1Nc2ccc(Cl)cc2C12CC2c1ccccn1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.73
PLK4 O00444 9/20 0.42
AURKB Q96GD4 6/20 0.42
CYP2C19 P33261 1/20 0.42
FLT3 P36888 1/20 0.42
GAA P10253 2/20 0.39
MGAM O43451 1/20 0.39
HTR1A P08908 1/20 0.39
SI P14410 1/20 0.39
HTR2A P28223 1/20 0.39
HTR7 P34969 1/20 0.39
HTR6 P50406 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
TRPM5 Q9NZQ8 1/20 0.39
TP53 P04637 1/20 0.39
MDM2 Q00987 1/20 0.39
PGR P06401 3/20 0.39
SNRNP200 O75643 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL14547228 0.90 GSK3B (0.59) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL5568336 0.82 GSK3B (0.49) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL14547133 0.82 GSK3B (0.48) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL14547263 0.82 GSK3B (0.48) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL14547269 0.81 GSK3B (0.47) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL14547145 0.81 GSK3B (0.47) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL14547305 0.81 PLK4 (0.49) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL14547144 0.79 GSK3B (0.46) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL14547275 0.79 GSK3B (0.46) GSK3BPLK4AURKBCYP2C19FLT3
SCHEMBL1975786 0.78 PLK4 (0.49) GSK3BPLK4AURKBCYP2C19FLT3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7205328-B2 Aids viricide IRM LLC (BM) 2007-04-17 US disclosed
US-7205328-B2 Aids viricide IRM LLC (BM) 2007-04-17 US disclosed
US-7205328-B2 Aids viricide IRM LLC (BM) 2007-04-17 US disclosed
US-20040152755-A1 Oxindoles with anti-HIV activity IRM LLC, A DELAWARE LLC (BM) 2004-08-05 US disclosed
WO-2004037247-A1 OXINDOLES WITH ANTI-HIV ACTIVITY IRM LLC (BM) 2004-05-06 WO 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-20040152755-A1 Oxindoles with anti-HIV activity IDO1, API5, NFATC1 GSK3B 566/4885PLK4 1823/4885AURKB 1397/4885

“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.