SCHEMBL7093565

SCHEMBL7093565

Brc1ccccc1OCCCN1CCN(c2cccc3[nH]ccc23)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 5/20 0.55
DRD2 P14416 4/20 0.55
DRD4 P21917 1/20 0.55
KDM4E B2RXH2 2/20 0.52
GAA P10253 3/20 0.51
MAPT P10636 1/20 0.51
ADRA1A P35348 1/20 0.48
ALDH1A1 P00352 2/20 0.48
FAAH O00519 1/20 0.47
CNR1 P21554 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR6 P50406 1/20 0.47
LMNA P02545 1/20 0.46
HTR2A P28223 2/20 0.46
HTR7 P34969 2/20 0.46
HRH3 Q9Y5N1 1/20 0.46
HTR1A P08908 1/20 0.44
SLC6A4 P31645 1/20 0.44
MEN1 O00255 1/20 0.44
GFER P55789 1/20 0.44

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
SCHEMBL7094229 0.87 GAA (0.62) DRD3DRD2DRD4GAAMAPT
SCHEMBL7090063 0.86 DRD2 (0.54) DRD3DRD2DRD4ADRA1AFAAH
SCHEMBL7599193 0.85 GAA (0.47) DRD3DRD2DRD4KDM4EGAA
SCHEMBL7094166 0.84 DRD2 (0.54) DRD3DRD2DRD4GAAMAPT
SCHEMBL7090512 0.84 ALDH1A1 (0.62) DRD3DRD2DRD4KDM4EGAA
SCHEMBL7096234 0.82 DRD2 (0.56) DRD3DRD2DRD4KDM4EGAA
SCHEMBL7090526 0.82 DRD2 (0.53) DRD3DRD2DRD4HTR2AHTR7
Hydrochloric Acid SCHEMBL29046768 0.81 DRD2 (0.52) DRD3DRD2DRD4HTR2AHTR7
SCHEMBL5123496 0.81 DRD2 (0.50) DRD3DRD2DRD4GAAMAPT
SCHEMBL7094235 0.81 GAA (0.52) DRD3DRD2DRD4GAAMAPT

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-20030050307-A1 Novel indole derivatives H. LUNDBECK A/S (DK) 2003-03-13 US claimed
US-20030050307-A1 Novel indole derivatives H. LUNDBECK A/S (DK) 2003-03-13 US disclosed
EP-1246818-A1 NOVEL INDOLE DERIVATIVES H. LUNDBECK A/S (DK) 2002-10-09 EP disclosed
WO-2001049680-A1 NOVEL INDOLE DERIVATIVES H. LUNDBECK A/S (DK) 2001-07-12 WO 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-20030050307-A1 Novel indole derivatives HTR1A, HTR3C, HTR2C DRD3 25/4885DRD2 27/4885DRD4 37/4885

“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.