SCHEMBL5161864

SCHEMBL5161864

COC(=O)c1c(-c2ccc(OC)cc2)c2cc(OC)c(OC)cc2n1CC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 4/20 0.47
EDNRA P25101 4/20 0.44
EDNRB P24530 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL5162772 0.91 MAPK8 (0.45) MAPK8EDNRAEDNRBL3MBTL1TP53
SCHEMBL4592238 0.90 MAPK8 (0.44) MAPK8EDNRAEDNRBL3MBTL1TP53
SCHEMBL4600089 0.89 MAPK8 (0.44) MAPK8EDNRAEDNRBL3MBTL1TP53
SCHEMBL5427868 0.88 MAPK8 (0.43) MAPK8EDNRAEDNRBL3MBTL1TP53
SCHEMBL5157558 0.87 MAPT (0.42) MAPK8EDNRAEDNRBL3MBTL1TP53
SCHEMBL5157621 0.86 MAPK8 (0.45) MAPK8EDNRAEDNRBL3MBTL1TP53
SCHEMBL5174825 0.86 MAPK8 (0.45) MAPK8EDNRAEDNRBL3MBTL1MAPT
SCHEMBL5423167 0.86 MAPK8 (0.63) MAPK8EDNRAEDNRBTP53
SCHEMBL4591041 0.85 MAPK8 (0.44) MAPK8EDNRAEDNRBL3MBTL1TP53
SCHEMBL4592507 0.85 MAPK8 (0.44) MAPK8EDNRAEDNRBL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 US disclosed
EP-1750687-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2007-02-14 EP disclosed
WO-2005105213-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2005-11-10 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-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action IDO1, IDO2, INMT MAPK8 4076/4885EDNRA 662/4885EDNRB 1151/4885

“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.