SCHEMBL4440290

SCHEMBL4440290

Fc1ccc(Oc2ccc(Cl)cc2CBr)c(CBr)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 16/20 0.50
KCNH2 Q12809 8/20 0.50
HTR2A P28223 6/20 0.50
SLC6A2 P23975 11/20 0.46
SLC6A3 Q01959 9/20 0.46
CHRM1 P11229 1/20 0.40
NR3C1 P04150 1/20 0.39
NR3C2 P08235 1/20 0.39

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
SCHEMBL4442267 0.92 SLC6A4 (0.47) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL4436450 0.89 SLC6A4 (0.45) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL27794942 0.87 SLC6A4 (0.48) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL4448137 0.84 SLC6A4 (0.53) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL14774744 0.83 MEN1 (0.48) SLC6A4HTR2A
SCHEMBL4440976 0.82 SLC6A4 (0.42) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL4441929 0.82 SLC6A4 (0.49) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL14774605 0.82 PTGER1 (0.46) NR3C1NR3C2
SCHEMBL4439241 0.81 SLC6A4 (0.46) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL27773687 0.80 SLC6A4 (0.45) SLC6A4KCNH2HTR2ASLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2061754-A1 BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2009-05-27 EP disclosed
WO-2008115999-A1 BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2008-09-25 WO disclosed
US-20080234384-A1 BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2008-09-25 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-20080234384-A1 BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS FECH, SLC10A1, SLC40A1 SLC6A4 724/4885KCNH2 4463/4885HTR2A 2810/4885

“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.