SCHEMBL1204547

SCHEMBL1204547

CCCCN1CCc2cc(OC)cc3c2C1Cc1cccc(O)c1-3

nearest known ligand 0.90

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 7/20 0.90
▸ DRD2 P14416 6/20 0.90
▸ DRD3 P35462 3/20 0.90
▸ HTR1A P08908 3/20 0.73
▸ TH P07101 2/20 0.67
▸ HTR2A P28223 2/20 0.67
▸ HTR2B P41595 2/20 0.63
▸ HTR2C P28335 1/20 0.60

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
SCHEMBL1204548 1.00 DRD1 (0.90) DRD1DRD2DRD3HTR1ATH
SCHEMBL1204062 0.95 DRD1 (1.00) DRD1DRD2DRD3HTR1ATH
SCHEMBL1203363 0.95 DRD1 (1.00) DRD1DRD2DRD3HTR1ATH
SCHEMBL1204538 0.90 DRD1 (0.86) DRD1DRD2DRD3HTR1ATH
SCHEMBL1204536 0.90 DRD1 (0.86) DRD1DRD2DRD3HTR1ATH
SCHEMBL12877939 0.87 DRD1 (0.71) DRD1DRD2DRD3HTR1ATH
SCHEMBL15180898 0.85 DRD2 (0.87) DRD1DRD2DRD3HTR1ATH
SCHEMBL15170348 0.85 DRD1 (0.86) DRD1DRD2DRD3HTR1ATH
SCHEMBL1204057 0.85 DRD1 (0.78) DRD1DRD2DRD3HTR1ATH
SCHEMBL1204059 0.85 DRD1 (0.78) DRD1DRD2DRD3HTR1ATH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431591-B2 R(−)-2-methoxy-11-hydroxyaporphine and derivatives thereof THE MCLEAN HOSPITAL CORPORATION (US) 2013-04-30 — — US claimed
US-20110034446-A1 R(-)-2-METHOXY-11-HYDROXYAPORPHINE AND DERIVATIVES THEREOF THE MCLEAN HOSPITAL CORPORATION (US) 2011-02-10 — — US claimed
WO-2009009083-A1 R(-)-2-METHOXY-11-HYDROXYAPORPHINE AND DERIVATIVES THEREOF THE MCLEAN HOSPITAL CORPORATION (US) 2009-01-15 — — WO claimed
US-8431591-B2 R(−)-2-methoxy-11-hydroxyaporphine and derivatives thereof THE MCLEAN HOSPITAL CORPORATION (US) 2013-04-30 — — US disclosed
US-20110034446-A1 R(-)-2-METHOXY-11-HYDROXYAPORPHINE AND DERIVATIVES THEREOF THE MCLEAN HOSPITAL CORPORATION (US) 2011-02-10 — — 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-20110034446-A1 R(-)-2-METHOXY-11-HYDROXYAPORPHINE AND DERIVATIVES THEREOF SNCA, HTR3A, PARK7 DRD1 30/4885DRD2 18/4885DRD3 35/4885

“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.

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