SCHEMBL5578239

SCHEMBL5578239

O=C(Nc1c[nH]nc1-c1nc(-c2cc(-c3ccc(Cl)cc3)no2)c[nH]1)c1c(F)cccc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.41
ABL1 P00519 2/20 0.40
MAPT P10636 6/20 0.38
RXFP1 Q9HBX9 2/20 0.38
TP53 P04637 2/20 0.38
ROCK1 Q13464 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
STK17A Q9UEE5 2/20 0.38
CDC7 O00311 1/20 0.38
ROCK2 O75116 1/20 0.38
CDK8 P49336 1/20 0.38
DYRK1A Q13627 1/20 0.38
LRRK2 Q5S007 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
RAB9A P51151 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL14511660 0.85 THRB (0.38) THRBABL1MAPTRXFP1TP53
SCHEMBL5578299 0.82 CDK1 (0.43) THRBABL1MAPTROCK1CLK4
SCHEMBL5578150 0.81 CDK1 (0.45) ABL1MAPTTP53ROCK1CLK4
SCHEMBL5578275 0.79 JAK2 (0.46) ABL1MAPTROCK1CLK4STK17A
SCHEMBL5578316 0.77 RAB9A (0.50) MAPTRXFP1TP53RAB9AMEN1
SCHEMBL5579242 0.77 ABL1 (0.38) ABL1MAPTTP53ROCK1CLK4
SCHEMBL5578220 0.76 CDK1 (0.41) ABL1MAPTROCK1CLK4STK17A
SCHEMBL5578274 0.76 NPC1 (0.43) ABL1ROCK1RAB9ANPC1MAP4K4
SCHEMBL13314754 0.72 L3MBTL1 (0.51) RXFP1TP53RAB9AMEN1KMT2A
SCHEMBL1645364 0.72 MAPT (0.48) MAPTTP53ROCK1CLK4STK17A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070105900-A1 Pharmaceutical compounds ATEX THERAPEUTICS, LIMITED (GB) 2007-05-10 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-20070105900-A1 Pharmaceutical compounds AURKA, AURKC, CDK1 THRB 2947/4885ABL1 511/4885MAPT 1133/4885

“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.