SCHEMBL6401082

SCHEMBL6401082

NN1C(=O)CCN(c2cccc(Cl)c2)C1=O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.47
DRD3 P35462 8/20 0.47
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
ALOX12 P18054 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KCNH2 Q12809 6/20 0.46
ALOX5 P09917 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
DRD4 P21917 1/20 0.45
HTR2A P28223 1/20 0.45
CTSG P08311 1/20 0.45
CMA1 P23946 1/20 0.45

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
SCHEMBL6401435 0.83 L3MBTL1 (0.53) DRD2DRD3ALDH1A1MAPTALOX5
SCHEMBL6404669 0.83 DRD2 (0.48) DRD2DRD3ALDH1A1MAPTALOX5
SCHEMBL6399376 0.82 DRD2 (0.43) DRD2DRD3ALDH1A1LMNAMAPT
SCHEMBL6399716 0.82 MEN1 (0.59) DRD2DRD3ALDH1A1LMNAALOX12
SCHEMBL9819448 0.81 DRD2 (0.52) DRD2DRD3ALDH1A1LMNAMAPT
SCHEMBL1751576 0.74 ALOX5 (0.47) DRD2DRD3ALDH1A1LMNAMAPT
SCHEMBL6028118 0.73 ALDH1A1 (0.64) DRD2DRD3ALDH1A1LMNASMN1; SMN2
SCHEMBL6404679 0.72 RAB9A (0.51) DRD2DRD3ALDH1A1LMNAMAPT
SCHEMBL6399679 0.72 DRD2 (0.43) DRD2DRD3LMNAMAPTSMN1; SMN2
SCHEMBL15328097 0.71 HTR2A (0.54) DRD2DRD3ALDH1A1LMNAMAPT

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 DRD2 1723/4885DRD3 2242/4885ALDH1A1 408/4885

“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.