SCHEMBL5482233

SCHEMBL5482233

COCCN(C)c1ccc2c(ccn2C(=O)OC(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 1/20 0.41
▸ PIK3CD O00329 3/20 0.40
▸ ABL1 P00519 2/20 0.40
▸ EGFR P00533 2/20 0.40
▸ HCK P08631 2/20 0.40
▸ SRC P12931 2/20 0.40
▸ KDR P35968 2/20 0.40
▸ PIK3CA P42336 2/20 0.40
▸ PIK3CB P42338 2/20 0.40
▸ MTOR P42345 2/20 0.40
▸ PIK3CG P48736 2/20 0.40
▸ EPHB4 P54760 2/20 0.40
▸ PRKDC P78527 2/20 0.40
▸ PI4KB Q9UBF8 2/20 0.40
▸ CFTR P13569 2/20 0.36
▸ BUB1 O43683 1/20 0.36
▸ NR1H2 P55055 6/20 0.34
▸ DGAT1 O75907 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 1/20 0.33

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
SCHEMBL3835028 0.81 MAPT (0.43) HTR6PIK3CDABL1EGFRHCK
SCHEMBL10117911 0.79 PIK3CD (0.43) HTR6PIK3CDABL1EGFRHCK
SCHEMBL5481092 0.78 MAP4K1 (0.35) HTR6PIK3CDCFTRNR1H2DGAT1
SCHEMBL3033379 0.77 HTR6 (0.48) HTR6PIK3CDABL1EGFRHCK
SCHEMBL1053699 0.76 KMT2A (0.41) HTR6PIK3CDABL1EGFRHCK
SCHEMBL3046607 0.76 HTR6 (0.44) HTR6PIK3CDABL1EGFRHCK
SCHEMBL30230816 0.75 TUBB1 (0.55) HTR6PIK3CDABL1EGFRHCK
SCHEMBL2266733 0.75 TUBB1 (0.55) HTR6PIK3CDABL1EGFRHCK
SCHEMBL1273077 0.74 HTR6 (0.49) HTR6PIK3CDABL1EGFRHCK
SCHEMBL3269495 0.74 PIK3CD (0.47) HTR6PIK3CDABL1EGFRHCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070105851-A1 Indolyl-thienopyrazinone derivatives useful for treating hyperproliferative disorders and diseases associated with angiogenesis BAYER PHARMACEUTICALS CORPORATION (US) 2007-05-10 — — US disclosed
US-20070105851-A1 Indolyl-thienopyrazinone derivatives useful for treating hyperproliferative disorders and diseases associated with angiogenesis BAYER PHARMACEUTICALS CORPORATION (US) 2007-05-10 — — US disclosed
US-20070105851-A1 Indolyl-thienopyrazinone derivatives useful for treating hyperproliferative disorders and diseases associated with angiogenesis BAYER PHARMACEUTICALS CORPORATION (US) 2007-05-10 — — US disclosed
US-20060004011-A1 Indolyl pyrazinone derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER PHARMACEUTICALS CORPORATION (US) 2006-01-05 — — US disclosed
EP-1565455-A1 INDOLYL PYRAZINONE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS Bayer Pharmaceuticals Corporation (US) 2005-08-24 — — EP disclosed
WO-2004043950-A1 INDOLYL PYRAZINONE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH ANGIOGENESIS BAYER PHARMACEUTICALS CORPORATION (US) 2004-05-27 — — 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 (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-20070105851-A1 Indolyl-thienopyrazinone derivatives useful for treating hyperproliferative disorders and diseases associated with angiogenesis MKI67, CDK4, PGF HTR6 752/4885PIK3CD 426/4885ABL1 173/4885
US-20060004011-A1 Indolyl pyrazinone derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis MKI67, VEGFA, FLT1 HTR6 1273/4885PIK3CD 624/4885ABL1 868/4885

“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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