SCHEMBL6763070

SCHEMBL6763070

Oc1ccccc1N1CCC(CNCC2COc3ccc(Cl)cc3O2)CC1

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 13/20 0.76
ADRA1A P35348 13/20 0.76
ADRA1B P35368 13/20 0.76
DRD2 P14416 3/20 0.76
DRD4 P21917 3/20 0.76
DRD3 P35462 3/20 0.76
HTR1A P08908 1/20 0.76
HTR2C P28335 1/20 0.76
CA2 P00918 2/20 0.50
CA1 P00915 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
SCHEMBL6761937 1.00 ADRA1D (0.76) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL6767394 0.86 ADRA1D (1.00) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL6766884 0.86 ADRA1D (1.00) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL6760339 0.85 ADRA1D (0.59) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL6760338 0.85 ADRA1D (0.59) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL7474062 0.84 ADRA1D (0.94) ADRA1DADRA1AADRA1BDRD2DRD4
Hydrochloric Acid SCHEMBL8126382 0.82 ADRA1D (0.91) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL7473727 0.82 ADRA1D (1.00) ADRA1DADRA1AADRA1BDRD2DRD4
SCHEMBL6763063 0.81 ADRA1D (0.54) ADRA1DADRA1AADRA1BDRD2DRD4
Hydrochloric Acid SCHEMBL8131921 0.81 ADRA1D (0.98) ADRA1DADRA1AADRA1BDRD2DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040039023-A1 Therapeutic agents KNOLL GMBH (DE) 2004-02-26 US claimed
US-20040039023-A1 Therapeutic agents KNOLL GMBH (DE) 2004-02-26 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-20040039023-A1 Therapeutic agents AMY1A, PARK7, SNCA ADRA1D 16/4885ADRA1A 27/4885ADRA1B 84/4885

“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.