SCHEMBL4130658

SCHEMBL4130658

CCOC(=O)c1cccc(-c2ccc3c(c2)CCC(N2CCCC2C)C3)c1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
DRD3 P35462 1/20 0.41
GALR1 P47211 1/20 0.40
PIK3CA P42336 1/20 0.40
ATM Q13315 1/20 0.40
DPP4 P27487 1/20 0.39
DPP7 Q9UHL4 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL4149013 0.91 DRD3 (0.44) DRD3HRH3MAPK1
SCHEMBL4149102 0.86 ALOX5 (0.44) ALOX5DRD3GALR1ATMDPP4
SCHEMBL4136466 0.86 PDE4A (0.43) HRH3LMNA
SCHEMBL3324704 0.85 TDP2 (0.41) DPP4HRH3LMNA
SCHEMBL3324698 0.85 TDP2 (0.41) DPP4HRH3LMNA
SCHEMBL3323263 0.85 TDP2 (0.41) DPP4HRH3LMNA
SCHEMBL4142054 0.81 HRH3 (0.49) DRD3HRH3LMNA
SCHEMBL4135775 0.81 HTR2C (0.41) DRD3HRH3LMNA
SCHEMBL4141100 0.81 HRH3 (0.38) HRH3LMNA
SCHEMBL4135773 0.80 CYP11B1 (0.37) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 US claimed

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 ALOX5 2512/4885DRD3 167/4885GALR1 180/4885

“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.