SCHEMBL6833481

SCHEMBL6833481

Cc1cc(B(O)O)ccc1OCc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 3/20 0.52
PPARA Q07869 1/20 0.47
MRGPRX4 Q96LA9 3/20 0.47
CCR5 P51681 5/20 0.45
FFAR4 Q5NUL3 2/20 0.44
FFAR1 O14842 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NFKB1 P19838 1/20 0.44
RAB9A P51151 1/20 0.44
NFKB2 Q00653 1/20 0.44
KMT2A Q03164 1/20 0.44
RELA Q04206 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HDAC1 Q13547 1/20 0.43

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
SCHEMBL2554749 0.91 MRGPRX4 (0.53) ENPP2PPARAMRGPRX4CCR5FFAR4
SCHEMBL29954144 0.85 LIPE (0.57) ENPP2MRGPRX4FFAR4FFAR1SMN1; SMN2
SCHEMBL1163386 0.85 LIPE (0.57) ENPP2MRGPRX4FFAR4FFAR1SMN1; SMN2
SCHEMBL20629081 0.82 MRGPRX4 (0.58) PPARAMRGPRX4CCR5FFAR4FFAR1
SCHEMBL2561404 0.82 MRGPRX4 (0.51) ENPP2MRGPRX4FFAR4FFAR1SMN1; SMN2
SCHEMBL257757 0.82 ENPP2 (0.41) ENPP2MRGPRX4CCR5SMN1; SMN2MEN1
SCHEMBL2559560 0.82 MRGPRX4 (0.63) ENPP2MRGPRX4FFAR4FFAR1SMN1; SMN2
SCHEMBL2558867 0.79 MRGPRX4 (0.62) ENPP2MRGPRX4SMN1; SMN2NPC1RAB9A
SCHEMBL6610128 0.78 CCR5 (0.49) PPARAMRGPRX4CCR5FFAR4FFAR1
SCHEMBL9893596 0.78 MRGPRX4 (0.54) ENPP2MRGPRX4FFAR4FFAR1SMN1; SMN2

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-20040157740-A1 Heterocyclyl phenyl benzyl ethers used as fungicides BAYER CROPSCIENCE AG (DE) 2004-08-12 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-20040157740-A1 Heterocyclyl phenyl benzyl ethers used as fungicides DDT, CYP4X1, PAH ENPP2 1596/4885PPARA 1479/4885MRGPRX4 3743/4885

“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.