SCHEMBL13745976

SCHEMBL13745976

c1ccc(COc2ccccc2-c2cnc3[nH]cc(-c4ccoc4)c3c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 2/20 0.67
IGF1R P08069 2/20 0.51
CAMKK2 Q96RR4 2/20 0.48
AXL P30530 1/20 0.48
TNIK Q9UKE5 1/20 0.48
CCNT1 O60563 1/20 0.47
CCNA2 P20248 1/20 0.47
CDK2 P24941 1/20 0.47
CDK9 P50750 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
SGK1 O00141 1/20 0.46
KIT P10721 3/20 0.44
AAK1 Q2M2I8 1/20 0.44

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
SCHEMBL13745986 0.87 CDK8 (0.66) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL8313420 0.85 CDK8 (0.64) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL13745996 0.85 CDK8 (0.69) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL8321129 0.85 CDK8 (0.69) CDK8IGF1RCAMKK2KITAAK1
SCHEMBL8313364 0.84 CDK8 (0.62) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL8324861 0.83 CDK8 (0.85) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL8325098 0.82 CDK8 (0.65) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL8321184 0.82 CDK8 (0.65) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL13746513 0.81 CDK8 (0.60) CDK8IGF1RCAMKK2AXLTNIK
SCHEMBL13745464 0.81 CDK8 (1.00) CDK8IGF1RCAMKK2AXLTNIK

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 4 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

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 360/4885IGF1R 1197/4885CAMKK2 94/4885

“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.