SCHEMBL1302196

SCHEMBL1302196

COC(=O)c1cccc2cc(C(=O)Nc3cc(C(C)(C)C)cc(NS(C)(=O)=O)c3OC)n(C)c12

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.57
LYN P07948 1/20 0.45
MAPK9 P45984 1/20 0.45
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
SCARB1 Q8WTV0 6/20 0.42
BRAF P15056 2/20 0.42

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
SCHEMBL13798002 0.89 MAPK14 (0.58) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL1302956 0.89 MAPK14 (0.58) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL13359214 0.88 MAPK14 (0.59) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL13798005 0.88 MAPK14 (0.59) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL1303140 0.88 MAPK14 (0.58) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL13359263 0.87 MAPK14 (0.54) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL13986422 0.87 MAPK14 (0.52) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL13359207 0.87 MAPK14 (0.56) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL1302236 0.87 MAPK14 (0.58) MAPK14LYNMAPK9SCARB1BRAF
SCHEMBL13810719 0.87 MAPK14 (0.56) MAPK14LYNMAPK9SCARB1BRAF

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-20110269737-A1 7-(Piperazine-1-Ymethyl)-1H-Indole-2-Carboxylic Acid (Phenyl)-Amide Derivatives and Allied Compounds as P38 Map Kinase Inhibitors for the Treatment of Respiratory Diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 US disclosed
US-20110269737-A1 7-(Piperazine-1-Ymethyl)-1H-Indole-2-Carboxylic Acid (Phenyl)-Amide Derivatives and Allied Compounds as P38 Map Kinase Inhibitors for the Treatment of Respiratory Diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 US disclosed
US-20110269737-A1 7-(Piperazine-1-Ymethyl)-1H-Indole-2-Carboxylic Acid (Phenyl)-Amide Derivatives and Allied Compounds as P38 Map Kinase Inhibitors for the Treatment of Respiratory Diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 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-20110269737-A1 7-(Piperazine-1-Ymethyl)-1H-Indole-2-Carboxylic Acid (Phenyl)-Amide Derivatives and Allied Compounds as P38 Map Kinase Inhibitors for the Treatment of Respiratory Diseases MAPKAPK2, MAPKAPK5, MAPK7 MAPK14 19/4885LYN 853/4885MAPK9 49/4885

“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.