SCHEMBL8319988

SCHEMBL8319988

COc1ccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 1/20 0.72
KIT P10721 9/20 0.67
DYRK1A Q13627 2/20 0.64
CCNT1 O60563 2/20 0.61
CCNA2 P20248 2/20 0.61
CDK2 P24941 2/20 0.61
CDK9 P50750 2/20 0.61
MAP3K11 Q16584 1/20 0.56
PIK3CA P42336 1/20 0.54

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
SCHEMBL13745489 0.88 CDK8 (0.69) CDK8KITDYRK1ACCNT1CCNA2
SCHEMBL13745270 0.87 CDK8 (0.71) CDK8KITDYRK1A
SCHEMBL15833785 0.87 KIT (0.81) CDK8KITDYRK1ACCNT1CCNA2
SCHEMBL8313358 0.86 CDK8 (0.77) CDK8KITDYRK1ACCNT1CCNA2
SCHEMBL8320052 0.86 KIT (0.62) CDK8KITDYRK1A
SCHEMBL13745494 0.86 KIT (0.71) CDK8KITDYRK1ACCNT1CCNA2
SCHEMBL8321586 0.86 CDK8 (0.80) CDK8KITCCNT1CCNA2CDK2
SCHEMBL8313522 0.86 KIT (0.78) CDK8KITDYRK1APIK3CA
SCHEMBL8320115 0.86 CDK8 (0.84) CDK8KITDYRK1ACCNT1CCNA2
SCHEMBL13753932 0.85 CDK8 (0.58) CDK8KITDYRK1ACCNT1CCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CDK8 360/4885KIT 3148/4885DYRK1A 1619/4885

“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.