SCHEMBL5899207

SCHEMBL5899207

CC(C)Oc1ccccc1C1CCN(Cc2cccc(C(=O)N3CCc4ccc(N)cc43)c2)CC1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.62
ADRA1D P25100 2/20 0.62
ADRA1A P35348 2/20 0.62
ADRA1B P35368 2/20 0.62
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
DRD2 P14416 1/20 0.48
HTR1B P28222 1/20 0.48
DRD3 P35462 1/20 0.48
CCR5 P51681 1/20 0.46

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
SCHEMBL5899201 0.91 MEN1 (0.63) HTR1AADRA1DADRA1AADRA1BMEN1
SCHEMBL5814914 0.91 HTR1A (0.75) HTR1AADRA1DADRA1AADRA1BMEN1
SCHEMBL5820560 0.86 HTR1A (0.84) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL5820685 0.84 ADRA1D (0.55) HTR1AADRA1DADRA1AADRA1BMEN1
SCHEMBL5820519 0.83 HTR1A (0.54) HTR1AADRA1DADRA1AADRA1BMEN1
SCHEMBL5823977 0.83 MEN1 (0.53) HTR1AMEN1KMT2ADRD2CCR5
SCHEMBL5815076 0.80 HTR1A (0.84) HTR1AADRA1DADRA1AADRA1BDRD2
SCHEMBL9540927 0.80 HTR1A (0.70) HTR1AADRA1DADRA1AADRA1BMEN1
Hydrochloric Acid SCHEMBL7648536 0.79 HTR1A (0.69) HTR1AADRA1DADRA1AADRA1BMEN1
SCHEMBL5803650 0.78 MEN1 (0.49) HTR1AADRA1DADRA1AADRA1BMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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.