SCHEMBL6401719

SCHEMBL6401719

NC(=O)N1C(=O)[N]C(=O)c2cc(Cl)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
AADAT Q8N5Z0 1/20 0.35
PPOX P50336 1/20 0.35
MYC P01106 1/20 0.35
NR4A1 P22736 1/20 0.35
APAF1 O14727 1/20 0.35
ALDH3A1 P30838 4/20 0.34
S100A4 P26447 1/20 0.34
MITF O75030 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TLR9 Q9NR96 1/20 0.34
KDM4E B2RXH2 3/20 0.33
IDO1 P14902 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
PABPC1 P11940 1/20 0.33

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
SCHEMBL6406733 0.88 AADAT (0.35) ALDH1A1AADATPPOXMYCNR4A1
SCHEMBL6401710 0.83 P2RX4 (0.40) ALDH1A1KDM4EMEN1CYP3A4MAPT
SCHEMBL6406364 0.78 HSD17B10 (0.42) ALDH1A1AADATHTTKDM4EIDO1
SCHEMBL6404457 0.78 MEN1 (0.50) ALDH1A1HTTKDM4EMEN1CYP3A4
SCHEMBL6401445 0.76 ALPL (0.32)
SCHEMBL6403687 0.73 ALPL (0.36) ALDH1A1KDM4EIDO1MEN1CYP3A4
SCHEMBL6400176 0.70 TSHR (0.38) ALDH1A1AADATKDM4EIDO1MEN1
SCHEMBL641926 0.68 OPRK1 (0.47) ALDH1A1MITFHSP90AA1HTTATM
Tenidap SCHEMBL3751878 0.67 MEN1 (0.42) ALDH1A1HSP90AA1HTTNPSR1KDM4E
Tenidap SCHEMBL24922 0.67 MEN1 (0.42) ALDH1A1HSP90AA1HTTNPSR1KDM4E

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 ALDH1A1 408/4885AADAT 15/4885PPOX 3798/4885

“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.