SCHEMBL4909956

SCHEMBL4909956

FC(F)(F)c1cc(Oc2c[c]ccc2)cc(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 8/20 0.38
TEAD1 P28347 1/20 0.35
TLR7 Q9NYK1 5/20 0.35
GPR84 Q9NQS5 1/20 0.35
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LTA4H P09960 1/20 0.33
KIF11 P52732 1/20 0.33
ALDH1A1 P00352 1/20 0.32
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32

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
SCHEMBL919095 0.88 TEAD1 (0.46) TLR8TEAD1TLR7POLBL3MBTL1
SCHEMBL921675 0.84 MAPK14 (0.41) LTA4HKIF11ALDH1A1
SCHEMBL3110393 0.81 RAB9A (0.37) TLR8TLR7CYP1A2CYP2C19
SCHEMBL8155454 0.79 LTA4H (0.43) LTA4HALDH1A1
SCHEMBL1283659 0.78 TLR8 (0.41) TLR8TLR7L3MBTL1IDO1
SCHEMBL29723532 0.77 LTA4H (0.52) TLR8TLR7L3MBTL1CYP1A2CYP2C9
SCHEMBL920377 0.77 VEGFA (0.33) CYP1A2LTA4H
SCHEMBL3110346 0.76 RAB9A (0.34) TLR8TLR7CYP1A2CYP2C19
SCHEMBL10993237 0.75 FFAR1 (0.47) L3MBTL1NPSR1
SCHEMBL4907828 0.75 RHEB (0.32) POLBLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8283351-B2 Inhibiting cyctic fibrosis transmembrane conductance regulator polypeptide ; therapy for diarrhea and polycystic kidney disease INSTITUTE FOR ONEWORLD HEALTH (US) 2012-10-09 US disclosed
US-20080269206-A1 CFTR INHIBITOR COMPOUNDS AND USES THEREOF INSTITUTE FOR ONEWORLD HEALTH 2008-10-30 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-20080269206-A1 CFTR INHIBITOR COMPOUNDS AND USES THEREOF CFTR, PKD1, PKD2 TLR8 3740/4885TEAD1 2204/4885TLR7 3465/4885

“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.