SCHEMBL13745345

SCHEMBL13745345

CCOc1cccc(-c2cnc3[nH]cc(-c4ccoc4)c3c2)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 2/20 0.69
NTRK1 P04629 2/20 0.57
KIT P10721 5/20 0.56
IGF1R P08069 1/20 0.54
NEK1 Q96PY6 2/20 0.53
CCNT1 O60563 1/20 0.51
CCNA2 P20248 1/20 0.51
CDK2 P24941 1/20 0.51
CDK9 P50750 1/20 0.51
AXL P30530 1/20 0.50
TNIK Q9UKE5 1/20 0.50
AAK1 Q2M2I8 1/20 0.48

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
SCHEMBL13745270 0.90 CDK8 (0.71) CDK8NTRK1KITIGF1RNEK1
SCHEMBL13745489 0.89 CDK8 (0.69) CDK8KITIGF1RCCNT1CCNA2
SCHEMBL8313414 0.85 CDK8 (0.67) CDK8NTRK1KITIGF1RNEK1
SCHEMBL8313308 0.84 CDK8 (0.76) CDK8NTRK1KITIGF1RNEK1
SCHEMBL8941639 0.84 AXL (0.68) CDK8NTRK1KITIGF1RNEK1
SCHEMBL13745366 0.83 CDK8 (0.77) CDK8NTRK1KITIGF1RCCNT1
SCHEMBL13745986 0.83 CDK8 (0.66) CDK8KITIGF1RCCNT1CCNA2
SCHEMBL13745464 0.82 CDK8 (1.00) CDK8NTRK1KITIGF1RCCNT1
SCHEMBL8320115 0.82 CDK8 (0.84) CDK8NTRK1KITIGF1RCCNT1
SCHEMBL13745368 0.82 CDK8 (0.76) CDK8NTRK1KITIGF1RCCNT1

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 360/4885NTRK1 1855/4885KIT 3148/4885

“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.