SCHEMBL6405074

SCHEMBL6405074

O=C(NNC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.72
BCAT1 P54687 4/20 0.56
NHERF1 O14745 4/20 0.55
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
ALDH1A1 P00352 1/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TLR7 Q9NYK1 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
GUSB P08236 2/20 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
SCHEMBL6398132 0.88 MAPT (0.68) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6404723 0.87 NHERF1 (0.62) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6400591 0.85 GUSB (0.61) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6399657 0.82 NHERF1 (0.58) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6407379 0.82 BCAT1 (0.67) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6405713 0.80 MAPT (0.70) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL4938637 0.80 MAPT (0.58) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6406653 0.80 MEN1 (0.75) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6400859 0.80 PYGL (0.56) MAPTBCAT1NHERF1MEN1KMT2A
SCHEMBL6400655 0.79 NHERF1 (0.69) MAPTBCAT1NHERF1MEN1KMT2A

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 MAPT 4405/4885BCAT1 854/4885NHERF1 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.