SCHEMBL6499706

SCHEMBL6499706

CCCCC(=O)Nc1cccc(-c2n[nH]c3ccc(N4C=CNN4)cc23)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 7/20 0.50
AURKB Q96GD4 5/20 0.50
TTK P33981 3/20 0.47
MAPK8 P45983 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
HPGD P15428 3/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CLK2 P49760 2/20 0.46
CLK3 P49761 2/20 0.46
DYRK1A Q13627 2/20 0.46
USP2 O75604 1/20 0.44
TSHR P16473 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 3/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 3/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL6501210 0.88 AURKA (0.51) AURKAAURKBTTKMAPK8
SCHEMBL6509037 0.85 TTK (0.57) AURKAAURKBTTKCLK2CLK3
SCHEMBL6507670 0.83 TTK (0.45) AURKAAURKBTTKMAPK8
SCHEMBL6506274 0.82 EPHX2 (0.44) AURKAAURKBTTKMAPK8TSHR
SCHEMBL6506793 0.81 ROCK2 (0.48) AURKAAURKBTTKMAPK8SMN1; SMN2
SCHEMBL6504170 0.79 ITK (0.48) AURKASMN1; SMN2HPGDHTTL3MBTL1
SCHEMBL6501248 0.78 AURKA (0.43) AURKAAURKBTTKMAPK8
SCHEMBL6503206 0.78 MEN1 (0.44) AURKATTKMAPK8
SCHEMBL5379093 0.76 TTK (0.54) AURKAAURKBTTKMAPK8SMN1; SMN2
SCHEMBL6793941 0.73 PARP1 (0.61) AURKASMN1; SMN2HPGDHTTL3MBTL1

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-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2005-01-13 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-20050009876-A1 Indazole compounds, compositions thereof and methods of treatment therewith GPR119, JAK3, IGF1R AURKA 1439/4885AURKB 1065/4885TTK 714/4885

“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.