SCHEMBL3258529

SCHEMBL3258529

O=C1CCc2ccc(OCCCCN3CCN(c4ccccc4O)CC3)cc2N1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 20/20 0.81
▸ DRD4 P21917 10/20 0.77
▸ DRD3 P35462 10/20 0.77
▸ DRD1 P21728 3/20 0.74
▸ DRD5 P21918 3/20 0.74
▸ HTR2A P28223 3/20 0.74
▸ HTR3E A5X5Y0 1/20 0.74
▸ MEN1 O00255 1/20 0.74
▸ MLNR O43193 1/20 0.74
▸ HTR3B O95264 1/20 0.74
▸ ABCB11 O95342 1/20 0.74
▸ ESR1 P03372 1/20 0.74
▸ PGR P06401 1/20 0.74
▸ ADRB2 P07550 1/20 0.74
▸ CHRM2 P08172 1/20 0.74
▸ ABCB1 P08183 1/20 0.74
▸ ADRB1 P08588 1/20 0.74
▸ HTR1A P08908 1/20 0.74
▸ ADRA2A P08913 1/20 0.74
▸ ADORA3 P0DMS8 1/20 0.74

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
SCHEMBL13532795 0.89 DRD2 (1.00) DRD2DRD4DRD3DRD1DRD5
SCHEMBL252295 0.87 DRD2 (1.00) DRD2DRD4DRD3
SCHEMBL10571409 0.86 DRD2 (0.94) DRD2DRD4DRD3DRD1DRD5
SCHEMBL10665990 0.86 DRD2 (1.00) DRD2DRD4DRD3MAOA
SCHEMBL5609347 0.86 DRD2 (0.76) DRD2DRD4DRD3DRD1DRD5
SCHEMBL30751117 0.86 DRD2 (0.76) DRD2DRD4DRD3DRD1DRD5
SCHEMBL14974690 0.86 DRD2 (1.00) DRD2DRD4DRD3
SCHEMBL8078 0.86 DRD2 (1.00) DRD2DRD4DRD3
SCHEMBL10572858 0.85 DRD2 (0.94) DRD2DRD4DRD3DRD1DRD5
SCHEMBL10576593 0.85 DRD2 (0.98) DRD2DRD4DRD3MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247420-B2 Compositions, synthesis, and methods of using quinolinone based atypical antipsychotic agents REVIVA PHARMACEUTICALS, INC. (US) 2012-08-21 — — US disclosed
US-8247420-B2 Compositions, synthesis, and methods of using quinolinone based atypical antipsychotic agents REVIVA PHARMACEUTICALS, INC. (US) 2012-08-21 — — US disclosed
US-8247420-B2 Compositions, synthesis, and methods of using quinolinone based atypical antipsychotic agents REVIVA PHARMACEUTICALS, INC. (US) 2012-08-21 — — US disclosed
EP-2162135-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF USING QUINOLINONE BASED ATYPICAL ANTIPSYCHOTIC AGENTS Reviva Pharmaceuticals, Inc. (US) 2010-03-17 — — EP disclosed
WO-2008144764-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF USING QUINOLINONE BASED ATYPICAL ANTIPSYCHOTIC AGENTS REVIVA PHARMACEUTICALS, INC. (US) 2008-11-27 — — WO disclosed
WO-2008144764-A1 COMPOSITIONS, SYNTHESIS, AND METHODS OF USING QUINOLINONE BASED ATYPICAL ANTIPSYCHOTIC AGENTS REVIVA PHARMACEUTICALS, INC. (US) 2008-11-27 — — WO disclosed
US-20080293736-A1 Compositions, Synthesis, and Methods of Using Quinolinone Based Atypical Antipsychotic Agents REVIVA PHARMACEUTICALS, INC. (US) 2008-11-27 — — US disclosed
US-20080293736-A1 Compositions, Synthesis, and Methods of Using Quinolinone Based Atypical Antipsychotic Agents REVIVA PHARMACEUTICALS, INC. (US) 2008-11-27 — — US disclosed
US-20080293736-A1 Compositions, Synthesis, and Methods of Using Quinolinone Based Atypical Antipsychotic Agents REVIVA PHARMACEUTICALS, INC. (US) 2008-11-27 — — 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-20080293736-A1 Compositions, Synthesis, and Methods of Using Quinolinone Based Atypical Antipsychotic Agents GRIN2D, GRIN2C, AP3D1 DRD2 26/4885DRD4 38/4885DRD3 64/4885

“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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