SCHEMBL12728992

SCHEMBL12728992

CCc1cnn2cc(I)ccc12

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.36
DRD3 P35462 3/20 0.36
DRD2 P14416 1/20 0.31
EPHB3 P54753 1/20 0.30

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
SCHEMBL12779139 0.81 DRD4 (0.32) DRD4DRD3
SCHEMBL23425908 0.80 EPHB3 (0.42) DRD4DRD3DRD2EPHB3
SCHEMBL25099101 0.79 EPHB3 (0.43) DRD4DRD3DRD2EPHB3
SCHEMBL23133667 0.79 KCNH2 (0.37) DRD4DRD3DRD2
SCHEMBL25045806 0.76 EPHB3 (0.32) EPHB3
SCHEMBL25044276 0.75
SCHEMBL18309178 0.75 CYP11B2 (0.40)
SCHEMBL26779153 0.75 NQO1 (0.41) DRD4DRD3DRD2
SCHEMBL26779173 0.73 HRH3 (0.36) DRD4DRD3DRD2
SCHEMBL9610941 0.70 DRD3 (0.58) DRD4DRD3DRD2EPHB3

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-8575337-B2 Oxazolidinone derivative having fused ring RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2013-11-05 US disclosed
US-20110098471-A1 OXAZOLIDINONE DERIVATIVE HAVING FUSED RING RESEARCH FOUNDATION ITSUU LABORATORY (JP) 2011-04-28 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-20110098471-A1 OXAZOLIDINONE DERIVATIVE HAVING FUSED RING OXER1, ALOX12, CYP1A1 DRD4 845/4885DRD3 377/4885DRD2 542/4885

“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.