SCHEMBL8444086

SCHEMBL8444086

CCOC(=O)Nc1cccc(-c2n[nH]c3ccc(C=O)cc23)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TTK P33981 5/20 0.58
MAPK8 P45983 4/20 0.58
AURKA O14965 10/20 0.58
AURKB Q96GD4 3/20 0.54
MAP2K7 O14733 2/20 0.48
PARP1 P09874 1/20 0.46
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
FGFR4 P22455 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
SCHEMBL5801915 0.84 TTK (0.60) TTKMAPK8AURKAAURKBMAP2K7
SCHEMBL8446250 0.82 AURKA (0.69) TTKMAPK8AURKAAURKBMAP2K7
SCHEMBL5381465 0.81 TTK (0.58) TTKMAPK8AURKAAURKBMAP2K7
SCHEMBL29773342 0.78 PARP1 (0.69) TTKMAPK8AURKAPARP1LMNA
SCHEMBL6786177 0.78 PARP1 (0.69) TTKMAPK8AURKAPARP1LMNA
SCHEMBL8449528 0.76 MAPK1 (0.53) TTKMAPK8AURKAAURKBMAP2K7
SCHEMBL5802293 0.74 TTK (0.52) TTKMAPK8AURKAAURKBMAP2K7
SCHEMBL5803505 0.73 MAP2K4 (0.53) TTKMAPK8AURKAAURKBMAP2K7
Hydrochloric Acid SCHEMBL5377781 0.73 TTK (0.51) TTKMAPK8AURKAAURKBMAP2K7
Hydrochloric Acid SCHEMBL5382200 0.73 TTK (0.51) TTKMAPK8AURKAAURKBMAP2K7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK SIGNAL PHARMACEUTICALS, LLC 2004-07-01 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-20040127536-A1 Methods for treating an inflammatory condition or inhibiting JNK MAPK1, MAP3K1, MAPKAPK2 TTK 1198/4885MAPK8 26/4885AURKA 3307/4885

“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.