SCHEMBL6400859

SCHEMBL6400859

CN(C)c1cccc(C(=O)NNC(=O)c2cc3cc(Cl)ccc3[nH]2)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PYGL P06737 6/20 0.56
CNR1 P21554 1/20 0.56
NHERF1 O14745 4/20 0.55
HRH4 Q9H3N8 1/20 0.54
HRH3 Q9Y5N1 1/20 0.54
BCAT1 P54687 3/20 0.53
MEN1 O00255 2/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.49

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
SCHEMBL6400614 0.96 BCAT1 (0.54) PYGLCNR1NHERF1HRH4HRH3
SCHEMBL6404723 0.87 NHERF1 (0.62) PYGLNHERF1BCAT1MEN1NPC1
SCHEMBL6407379 0.85 BCAT1 (0.67) PYGLNHERF1HRH4HRH3BCAT1
SCHEMBL6400591 0.82 GUSB (0.61) NHERF1BCAT1MEN1NPC1RAB9A
SCHEMBL6399657 0.82 NHERF1 (0.58) PYGLNHERF1BCAT1MEN1NPC1
SCHEMBL6406653 0.82 MEN1 (0.75) NHERF1BCAT1MEN1NPC1RAB9A
SCHEMBL6400655 0.81 NHERF1 (0.69) PYGLNHERF1BCAT1MEN1NPC1
SCHEMBL6405713 0.80 MAPT (0.70) PYGLNHERF1HRH4HRH3BCAT1
SCHEMBL6405074 0.80 MAPT (0.72) NHERF1BCAT1MEN1NPC1RAB9A
SCHEMBL6405183 0.79 MEN1 (0.53) PYGLNHERF1HRH4HRH3BCAT1

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 96/4885CNR1 259/4885NHERF1 332/4885

“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.