SCHEMBL31691990

SCHEMBL31691990

CC(F)c1cccc(Br)n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.38
S1PR2 O95136 1/20 0.36
S1PR4 O95977 1/20 0.36
S1PR3 Q99500 1/20 0.36
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35
HTR7 P34969 2/20 0.33
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
GRM5 P41594 1/20 0.30

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
SCHEMBL18415006 1.00 IRAK4 (0.38) IRAK4S1PR2S1PR4S1PR3PGK1
SCHEMBL30577788 0.84 IRAK4 (0.41) IRAK4S1PR2S1PR4S1PR3PGK1
SCHEMBL906775 0.84 IRAK4 (0.41) IRAK4S1PR2S1PR4S1PR3PGK1
SCHEMBL21264174 0.83 IRAK4 (0.37) IRAK4S1PR2S1PR4S1PR3PGK1
SCHEMBL29413191 0.82 S1PR2 (0.38) IRAK4S1PR2S1PR4S1PR3PGK1
SCHEMBL104442 0.82 S1PR2 (0.38) IRAK4S1PR2S1PR4S1PR3PGK1
SCHEMBL13762868 0.80 S1PR2 (0.41) IRAK4S1PR2S1PR4S1PR3HTR7
SCHEMBL1022830 0.80 S1PR2 (0.41) IRAK4S1PR2S1PR4S1PR3HTR7
SCHEMBL400366 0.78 IRAK4 (0.38) IRAK4S1PR2S1PR4S1PR3PGK1
SCHEMBL2036719 0.78 IRAK4 (0.38) IRAK4S1PR2S1PR4S1PR3PGK1

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-20250304577-A1 TYK2 INHIBITORS BIOGEN MA INC. 2025-10-02 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-20250304577-A1 TYK2 INHIBITORS TYK2, JAK2, JAK1 IRAK4 163/4885S1PR2 1555/4885S1PR4 3165/4885

“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.