SCHEMBL6752147

SCHEMBL6752147

Clc1ccc(OCCCCCCCBr)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.53
DRD4 P21917 4/20 0.51
ALDH3A1 P30838 1/20 0.51
DRD2 P14416 3/20 0.49
DRD3 P35462 3/20 0.49
KCNH2 Q12809 2/20 0.49
ALDH1A1 P00352 1/20 0.49

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
SCHEMBL7621718 1.00 HRH3 (0.53) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL10384122 1.00 HRH3 (0.53) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL7390013 1.00 HRH3 (0.53) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL1172364 0.98 DRD4 (0.53) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL4747583 0.94 LTA4H (0.50) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL17233002 0.94 HRH3 (0.49) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL4754349 0.91 DRD4 (0.55) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL28820095 0.89 DRD4 (0.47) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL11567216 0.89 ALDH3A1 (0.47) HRH3DRD4ALDH3A1DRD2DRD3
SCHEMBL4743108 0.89 ALDH3A1 (0.47) HRH3DRD4ALDH3A1DRD2DRD3

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-6706739-B2 TREATING ENTEROVIRUS INFECTION NATIONAL HEALTH RESEARCH INSTITUTE (TW) 2004-03-16 US disclosed
US-20030087936-A1 Imidazolidinone compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2003-05-08 US disclosed
US-6417192-B1 DRUGS WITH PYRIMIDONE COMPOUNDS INHIBITORS OF THE ENZYME LDL PLA.SUB.2 AND THEREFORE OF USE IN TREATING ATHEROSCLEROSIS. SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-09 US disclosed
US-4171376-A Aryloxyalkyl keto-esters STERLING DRUG INC. (US) 1979-10-16 US disclosed
US-4154850-A Certain di-(substituted phenoxy) alkanes and hypolipidaemic use thereof BEECHAM GROUP LIMITED (GB) 1979-05-15 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-20030087936-A1 Imidazolidinone compounds EIF2AK2, ZC3HAV1, EMG1 HRH3 365/4885DRD4 2759/4885ALDH3A1 4712/4885

“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.