SCHEMBL5899205

SCHEMBL5899205

O=C(O)N1CCN(Cc2cccc(C(=O)N3CCc4ccccc43)c2)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.65
ADRA1D P25100 3/20 0.65
ADRA1A P35348 3/20 0.65
ADRA1B P35368 3/20 0.65
ALDH1A1 P00352 2/20 0.59
HPGD P15428 1/20 0.59
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
LMNA P02545 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
TSHR P16473 1/20 0.57
MAPK1 P28482 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
GAA P10253 2/20 0.57
HTT P42858 1/20 0.57
RAB9A P51151 2/20 0.52
KDM4E B2RXH2 1/20 0.50
KDM1A O60341 1/20 0.49
DRD2 P14416 1/20 0.49
DRD4 P21917 1/20 0.49

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
SCHEMBL15031161 0.80 GAA (0.66) HTR1AADRA1DADRA1AADRA1BALDH1A1
SCHEMBL5899199 0.80 GAA (0.66) HTR1AADRA1DADRA1AADRA1BALDH1A1
SCHEMBL4838001 0.78 CYP2D6 (0.73) ALDH1A1HPGDMEN1KMT2ALMNA
SCHEMBL1696130 0.78 AVPR2 (0.65) HTR1AADRA1DADRA1AADRA1BALDH1A1
SCHEMBL18719367 0.77 GAA (0.62) HTR1AADRA1DADRA1AADRA1BALDH1A1
SCHEMBL1690106 0.77 GAA (0.62) HTR1AADRA1DADRA1AADRA1BALDH1A1
SCHEMBL5783412 0.76 HPGD (1.00) ALDH1A1HPGDMEN1KMT2ALMNA
SCHEMBL31556814 0.76 HPGD (1.00) ALDH1A1HPGDMEN1KMT2ALMNA
SCHEMBL7038584 0.76 SMN1; SMN2 (0.59) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL5814914 0.74 HTR1A (0.75) 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.