SCHEMBL6400680

SCHEMBL6400680

NC(=O)N1C(=O)NC(c2cccs2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
HTT P42858 1/20 0.44
KDM4E B2RXH2 2/20 0.42
ADORA2B P29275 5/20 0.41
PKM P14618 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL6400683 0.78 KDM4E (0.43) ALDH1A1MAPTL3MBTL1HTTKDM4E
SCHEMBL6401309 0.74 LMNA (0.50) ALDH1A1KMT2AMEN1
SCHEMBL6399674 0.74 LMNA (0.50) ALDH1A1KMT2AMEN1
SCHEMBL6398623 0.70 ESR1 (0.40) ALDH1A1KDM4EKMT2AMEN1
SCHEMBL6403763 0.70 GAA (0.50) ALDH1A1KDM4EPOLBGAAKMT2A
SCHEMBL6404442 0.69 TDP1 (0.44) MAPTKDM4EGAA
SCHEMBL31539486 0.66 ALDH1A1 (0.38) ALDH1A1MAPTL3MBTL1HTTKDM4E
SCHEMBL6404733 0.66 ALDH1A1 (0.47) ALDH1A1KDM4EGAA
SCHEMBL1823137 0.64 KDM4E (0.55) ALDH1A1MAPTL3MBTL1KDM4EADORA2B
SCHEMBL30718533 0.64 KDM4E (0.40) ALDH1A1MAPTL3MBTL1HTTKDM4E

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 408/4885MAPT 4405/4885L3MBTL1 1728/4885

“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.