SCHEMBL6505559

SCHEMBL6505559

CCN(CCCNC(=O)Cc1ccc(F)cc1)Cc1cccc(Oc2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.56
LTA4H P09960 1/20 0.56
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
APP P05067 3/20 0.48
ACKR3 P25106 3/20 0.48
RAB9A P51151 2/20 0.47
GAA P10253 1/20 0.47
BCHE P06276 1/20 0.45
FDFT1 P37268 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 2/20 0.44
KMT2A Q03164 1/20 0.44
GLA P06280 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL6503729 0.94 EPHX2 (0.58) EPHX2LTA4HTSHRHSD17B10RAB9A
SCHEMBL6499418 0.91 APP (0.46) EPHX2LTA4HAPPACKR3RAB9A
SCHEMBL6499395 0.89 BCHE (0.56) EPHX2LTA4HTSHRHSD17B10APP
SCHEMBL6507792 0.88 MTNR1A (0.51) TSHRHSD17B10APPGAAKMT2A
SCHEMBL6499869 0.87 ACKR3 (0.58) TSHRHSD17B10APPACKR3RAB9A
SCHEMBL6500080 0.86 CCR8 (0.50) APPGAABCHELMNAGLA
SCHEMBL6506029 0.84 LMNA (0.55) TSHRHSD17B10APPGAABCHE
SCHEMBL6501980 0.84 GAA (0.69) TSHRHSD17B10APPACKR3GAA
SCHEMBL6529392 0.84 TSHR (0.48) TSHRHSD17B10APPACKR3GAA
SCHEMBL6498185 0.84 TSHR (0.49) TSHRHSD17B10APPACKR3RAB9A

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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 EPHX2 796/4885LTA4H 197/4885TSHR 3179/4885

“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.