SCHEMBL6406357

SCHEMBL6406357

COc1ccc(C(Br)=C2C(=O)Nc3ccccc32)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.75
▸ MAPT P10636 5/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ GAA P10253 2/20 0.52
▸ TTR P02766 1/20 0.52
▸ LRRK2 Q5S007 1/20 0.52
▸ APP P05067 1/20 0.48
▸ SNCA P37840 1/20 0.48
▸ IDO1 P14902 2/20 0.47
▸ TDO2 P48775 1/20 0.47
▸ TNKS2 Q9H2K2 1/20 0.45
▸ HSP90AA1 P07900 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ MDM2 Q00987 1/20 0.44
▸ NTSR1 P30989 1/20 0.44
▸ CSNK1D P48730 3/20 0.43
▸ CSNK1A1 P48729 2/20 0.43
▸ CSNK1E P49674 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ GMNN O75496 1/20 0.43

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
SCHEMBL29670839 0.86 TDP1 (1.00) TDP1MAPTALDH1A1GAATTR
SCHEMBL725960 0.86 TDP1 (1.00) TDP1MAPTALDH1A1GAATTR
SCHEMBL2825852 0.83 TDP1 (0.75) TDP1MAPTALDH1A1GAATTR
SCHEMBL2825850 0.83 TDP1 (0.75) TDP1MAPTALDH1A1GAATTR
SCHEMBL13207340 0.83 TDP1 (0.75) TDP1MAPTALDH1A1GAATTR
SCHEMBL6327059 0.78 TDP1 (0.63) TDP1MAPTALDH1A1GAATTR
SCHEMBL6327062 0.78 TDP1 (0.63) TDP1MAPTALDH1A1GAATTR
SCHEMBL14102720 0.77 TDP1 (0.51) TDP1MAPTALDH1A1GAATTR
SCHEMBL6744829 0.75 TDP1 (0.73) TDP1MAPTALDH1A1GAATTR
SCHEMBL6744832 0.75 TDP1 (0.73) TDP1MAPTALDH1A1GAATTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855730-B2 3-methylidenyl-2-indolinone modulators of protein kinase SUGEN, INC. (US) 2005-02-15 — — US disclosed
US-20040024010-A1 3-methylidenyl-2-indolinone modulators of protein kinase SUGEN, INC. 2004-02-05 — — US disclosed
US-6531502-B1 Antitumor SUGEN, INC. 2003-03-11 — — 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-20040024010-A1 3-methylidenyl-2-indolinone modulators of protein kinase DMPK, MAP4K3, MAP3K20 TDP1 1082/4885MAPT 4113/4885ALDH1A1 2196/4885

“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.

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