SCHEMBL8313439

SCHEMBL8313439

COc1ccc(-c2cnc3[nH]cc(-c4cn[nH]c4)c3c2)cc1OC

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIT P10721 16/20 0.83
DYRK1A Q13627 2/20 0.83
AAK1 Q2M2I8 1/20 0.76
SLC2A1 P11166 1/20 0.74
PIK3CA P42336 1/20 0.71
MAP3K11 Q16584 1/20 0.71

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
SCHEMBL15833894 0.91 KIT (1.00) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL12763510 0.86 KIT (0.85) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL12763536 0.86 DYRK1A (1.00) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL8387938 0.86 AAK1 (1.00) KITDYRK1AAAK1SLC2A1
SCHEMBL3765259 0.85 SLC2A1 (1.00) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL1516600 0.85 KIT (0.83) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL17211640 0.85 KIT (0.88) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL17200869 0.85 KIT (0.91) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL15555511 0.85 KIT (0.83) KITDYRK1AAAK1SLC2A1PIK3CA
SCHEMBL15554740 0.85 KIT (0.91) KITDYRK1AAAK1SLC2A1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014004863-A2 COMPOUNDS, COMPOSITIONS, AND THERAPEUTIC USES THEREOF ALZHEIMER'S INSTITUTE OF AMERICA, INC. (US) 2014-01-03 WO disclosed
EP-2295433-A2 JNK inhibitors Eisai R&D Management Co., Ltd. (JP) 2011-03-16 EP disclosed
US-20090215771-A1 JNK INHIBITORS GRACZYK PIOTR 2009-08-27 US disclosed
US-20090215771-A1 JNK INHIBITORS GRACZYK PIOTR 2009-08-27 US disclosed
US-7432375-B2 JNK inhibitors EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-10-07 US disclosed
US-7432375-B2 JNK inhibitors EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-10-07 US disclosed
WO-2004078756-A2 JNK INHIBITORS EISAI CO., LTD. (JP) 2004-09-16 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-20090215771-A1 JNK INHIBITORS MAPKAPK2, MAPK1, MAPKAPK3 KIT 3148/4885DYRK1A 1619/4885AAK1 182/4885

“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.