SCHEMBL1933399

SCHEMBL1933399

CCOCC1CCc2ccc(O)cc2O1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.52
DRD4 P21917 2/20 0.52
DRD3 P35462 2/20 0.52
DRD1 P21728 1/20 0.52
DRD5 P21918 1/20 0.52

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
SCHEMBL17965962 0.84 DRD2 (0.58) DRD2DRD4DRD3DRD1DRD5
SCHEMBL13820728 0.81 CA2 (0.38)
SCHEMBL7115294 0.79 DRD2 (0.59) DRD2DRD4DRD3DRD1DRD5
SCHEMBL7114122 0.79 DRD2 (0.59) DRD2DRD4DRD3DRD1DRD5
SCHEMBL10635985 0.79 DRD2 (0.56) DRD2DRD4DRD3DRD1DRD5
SCHEMBL1933783 0.78 HTR6 (0.60) DRD2DRD4DRD3DRD1DRD5
SCHEMBL15201806 0.77 HRH3 (0.40) DRD3
SCHEMBL6505239 0.77 ESR1 (0.52)
SCHEMBL10664848 0.77 DRD2 (0.51) DRD2DRD4DRD3DRD1DRD5
SCHEMBL1932109 0.76 LPL (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120289501-A1 Benzene-fused 6-membered oxygen-containing heterocyclic derivatives of bicyclic heteroaryls NOVARTIS AG (CH) 2012-11-15 US disclosed
EP-2504339-A1 BENZENE-FUSED 6-MEMBERED OXYGEN-CONTAINING HETEROCYCLIC DERIVATIVES OF BICYCLIC HETEROARYLS Novartis AG (CH) 2012-10-03 EP disclosed
WO-2011064211-A1 BENZENE-FUSED 6-MEMBERED OXYGEN-CONTAINING HETEROCYCLIC DERIVATIVES OF BICYCLIC HETEROARYLS NOVARTIS AG (CH) 2011-06-03 WO 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-20120289501-A1 Benzene-fused 6-membered oxygen-containing heterocyclic derivatives of bicyclic heteroaryls CYP1B1, CYP11B2, CCNI DRD2 2022/4885DRD4 2001/4885DRD3 2309/4885

“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.