SCHEMBL7145582

SCHEMBL7145582

COc1cc2c(Oc3ccc(Br)cc3F)ncnc2cc1OCc1ccccc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.58
KDR P35968 7/20 0.51
EGFR P00533 7/20 0.51
IRAK1 P51617 1/20 0.50
IRAK4 Q9NWZ3 1/20 0.50
FLT4 P35916 2/20 0.48
CSF1R P07333 1/20 0.48
PDGFRB P09619 1/20 0.48
FLT3 P36888 1/20 0.48
RET P07949 2/20 0.47
KIF5B P33176 2/20 0.47
MET P08581 5/20 0.46
FLT1 P17948 1/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
KDM1A O60341 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
SCHEMBL4421590 0.94 TRPA1 (0.61) TRPA1KDREGFRIRAK1IRAK4
SCHEMBL7145586 0.83 TRPA1 (0.53) TRPA1KDREGFRIRAK1IRAK4
SCHEMBL8815929 0.83 IRAK1 (0.59) TRPA1KDREGFRIRAK1IRAK4
SCHEMBL4692996 0.83 TRPA1 (0.59) TRPA1KDREGFRFLT4CSF1R
SCHEMBL30002061 0.82 TRPA1 (0.61) TRPA1KDREGFRIRAK1IRAK4
SCHEMBL4028296 0.82 TRPA1 (0.61) TRPA1KDREGFRIRAK1IRAK4
SCHEMBL18550520 0.82 TRPA1 (0.61) TRPA1KDREGFRIRAK1IRAK4
SCHEMBL7145589 0.82 TRPA1 (0.45) TRPA1KDREGFRIRAK1IRAK4
SCHEMBL21408242 0.82 MET (0.58) KDREGFRMET
SCHEMBL30216641 0.82 MET (0.58) KDREGFRMET

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-20030225111-A1 Therapy ASTRAZENECA AB (SE) 2003-12-04 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-20030225111-A1 Therapy VEGFA, AQP1, FLT1 TRPA1 2378/4885KDR 39/4885EGFR 1578/4885

“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.