SCHEMBL4426012

SCHEMBL4426012

O=C(O)c1ccc(OCc2ccc(C(F)(F)F)cc2)c(F)c1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.68
RXRB P28702 4/20 0.68
RXRG P48443 4/20 0.68
MRGPRX4 Q96LA9 11/20 0.56
PTGER1 P34995 1/20 0.53
MAOB P27338 2/20 0.52
PPARA Q07869 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
SCHEMBL20463313 0.88 MAOB (0.65) RXRARXRBRXRGMRGPRX4MAOB
SCHEMBL4422888 0.87 RXRA (0.58) RXRARXRBRXRGMRGPRX4MAOB
SCHEMBL4428716 0.86 NR4A2 (0.63) RXRARXRBRXRGMRGPRX4PTGER1
SCHEMBL22386717 0.86 RXRA (0.54) RXRARXRBRXRGMRGPRX4PTGER1
SCHEMBL22386776 0.85 RXRA (0.53) RXRARXRBRXRGMRGPRX4PTGER1
SCHEMBL229472 0.84 MRGPRX4 (0.69) RXRARXRBRXRGMRGPRX4PTGER1
SCHEMBL20456188 0.84 MRGPRX4 (0.70) RXRARXRBRXRGMRGPRX4MAOB
SCHEMBL4435052 0.84 RXRA (0.55) RXRARXRBRXRGMRGPRX4PTGER1
SCHEMBL4432652 0.83 MRGPRX4 (0.55) RXRARXRBRXRGMRGPRX4PPARA
SCHEMBL22480551 0.83 MRGPRX4 (0.76) MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515926-B1 FLUOROBENZAMIDES SUITABLE FOR THE TREATMENT OF ALZHEIMER'S DISEASE OR SENILE DEMENTIA HOFFMANN LA ROCHE (CH) 2009-04-08 EP disclosed
CN-1274669-C Fluorobenzamides suitable for the treatment of alzheimer's disease or senile dementia HOFFMANN LA ROCHE (CH) 2006-09-13 CN disclosed
US-6951884-B2 Fluorobenzamides and uses thereof HOFFMANN-LA ROCHE INC. (US) 2005-10-04 US disclosed
CN-1659135-A Fluorobenzamides suitable for the treatment of alzheimer's disease or senile dementia HOFFMANN LA ROCHE (CH) 2005-08-24 CN disclosed
EP-1515926-A2 FLUOROBENZAMIDES SUITABLE FOR THE TREATMENT OF ALZHEIMER'S DISEASE OR SENILE DEMENTIA F.HOFFMANN-LA ROCHE AG (CH) 2005-03-23 EP disclosed
US-20030236304-A1 Fluorobenzamides and uses thereof F. HOFFMANN-LA ROCHE AG (CH) 2003-12-25 US disclosed
WO-2003106380-A2 FLUOROBENZAMIDES F.HOFFMANN-LA ROCHE AG (CH) 2003-12-24 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-20030236304-A1 Fluorobenzamides and uses thereof MAOB, MAOA, BCHE RXRA 4166/4885RXRB 3055/4885RXRG 4364/4885

“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.