SCHEMBL6399711

SCHEMBL6399711

CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)c1cc2cc(Cl)ccc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PYGL P06737 16/20 0.52
NHERF1 O14745 1/20 0.52
HRH4 Q9H3N8 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
BCAT1 P54687 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
SCHEMBL6401289 0.88 NHERF1 (0.53) PYGLNHERF1HRH4HRH3BCAT1
SCHEMBL6401020 0.88 NHERF1 (0.58) PYGLNHERF1BCAT1
SCHEMBL6400331 0.86 NHERF1 (0.55) PYGLNHERF1HRH4HRH3BCAT1
SCHEMBL6400295 0.84 NHERF1 (0.55) PYGLNHERF1BCAT1
SCHEMBL6402210 0.83 NHERF1 (0.60) PYGLNHERF1BCAT1
SCHEMBL6405183 0.82 MEN1 (0.53) PYGLNHERF1HRH4HRH3BCAT1
SCHEMBL4937039 0.79 BCAT1 (0.57) PYGLNHERF1BCAT1
SCHEMBL6400057 0.79 NHERF1 (0.60) PYGLNHERF1HRH4HRH3BCAT1
SCHEMBL6406416 0.78 BCAT1 (0.67) PYGLNHERF1HRH4HRH3BCAT1
SCHEMBL6401177 0.77 KDM4E (0.68) PYGLNHERF1BCAT1

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-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US claimed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP claimed
US-20050054696-A1 Indole compounds and medicinal use thereof JAPAN TOBACCO INC. (JP) 2005-03-10 US disclosed
EP-1452526-A1 INDOLE COMPOUND AND MEDICINAL USE THEREOF JAPAN TOBACCO INC. (JP) 2004-09-01 EP 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-20050054696-A1 Indole compounds and medicinal use thereof IDO1, GPR119, SLC5A1 PYGL 96/4885NHERF1 332/4885HRH4 1853/4885

“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.