SCHEMBL5820233

SCHEMBL5820233

CC(C)Oc1ccccc1N1CCN(Cc2ccc(C(=O)N3CCc4ccccc43)cc2)CC1

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.81
ADRA1D P25100 2/20 0.81
ADRA1A P35348 2/20 0.81
ADRA1B P35368 2/20 0.81
DRD2 P14416 1/20 0.57
HTR1B P28222 1/20 0.57
DRD3 P35462 1/20 0.57
MEN1 O00255 1/20 0.55
MAPT P10636 1/20 0.55
KMT2A Q03164 1/20 0.55
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
HPGD P15428 1/20 0.54
TSHR P16473 1/20 0.54

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
SCHEMBL5816463 0.90 ADRA1D (0.67) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL9539641 0.83 HTR1A (0.80) HTR1AADRA1DADRA1AADRA1BDRD2
Hydrochloric Acid SCHEMBL7648139 0.82 HTR1A (0.79) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL5815076 0.81 HTR1A (0.84) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL5820560 0.81 HTR1A (0.84) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL5899226 0.79 HTR1A (0.79) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL8758360 0.78 ADRA1D (0.64) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL9546953 0.77 HTR1A (0.75) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL5820432 0.76 HTR1A (0.74) HTR1AADRA1DADRA1AADRA1BDRD2
Hydrochloric Acid SCHEMBL8758747 0.76 ADRA1D (0.62) HTR1AADRA1DADRA1AADRA1BDRD2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006088954-A1 DIHYDROINDOLYL METHANONES AS ALPHA 1A/1D ADRENORECEPTOR MODULATORS FOR THE TREATMENT OF BENIGN PROSTATIC HYPERTROPHY AND LOWER URINARY TRACT SYMPTOMS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-08-24 WO claimed
US-20060183902-A1 Dihydroindolyl methanones as alpha 1a/1d adrenoreceptor modulators for the treatment of benign prostatic hypertrophy and lower urinary tract symptoms JANSSEN PHARMACEUTICA, N.V. (BE) 2006-08-17 US claimed
US-20060183902-A1 Dihydroindolyl methanones as alpha 1a/1d adrenoreceptor modulators for the treatment of benign prostatic hypertrophy and lower urinary tract symptoms JANSSEN PHARMACEUTICA, N.V. (BE) 2006-08-17 US 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-20060183902-A1 Dihydroindolyl methanones as alpha 1a/1d adrenoreceptor modulators for the treatment of benign prostatic hypertrophy and lower urinary tract symptoms ADRA1D, ADRA1A, ADRB1 HTR1A 37/4885ADRA1D 1/4885ADRA1A 2/4885

“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.