SCHEMBL20755877

SCHEMBL20755877

Ic1cc(OCc2ccccc2)c(I)cc1OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.57
MAPT P10636 1/20 0.53
MAPK1 P28482 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HTR1A P08908 1/20 0.50
DRD2 P14416 1/20 0.50
MAOB P27338 1/20 0.48
LIPE Q05469 1/20 0.48
APP P05067 4/20 0.48
FOLH1 Q04609 1/20 0.47
MAPK14 Q16539 2/20 0.47
LTA4H P09960 1/20 0.47
ALOX5 P09917 1/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL29937368 0.87 FFAR1 (0.50) FFAR1MAPTMAPK1TDP1L3MBTL1
SCHEMBL18893984 0.87 FFAR1 (0.50) FFAR1MAPTMAPK1TDP1L3MBTL1
SCHEMBL13504468 0.85 FFAR1 (0.49) FFAR1MAPTMAPK1TDP1L3MBTL1
SCHEMBL17547014 0.85 SLC6A4 (0.54) FFAR1MAOB
SCHEMBL5109981 0.85 FFAR1 (0.56) FFAR1MAOB
SCHEMBL28843836 0.84 FFAR1 (0.59) FFAR1MAPTMAPK1TDP1L3MBTL1
SCHEMBL10471107 0.84 FFAR1 (0.48) FFAR1MAPTMAPK1TDP1L3MBTL1
SCHEMBL74678 0.83 MAPT (0.59) FFAR1MAPTMAPK1TDP1L3MBTL1
SCHEMBL23663419 0.82 FFAR1 (0.47) FFAR1MAPTMAPK1TDP1L3MBTL1
SCHEMBL584956 0.81 HTR1A (0.46) FFAR1MAPTMAPK1TDP1L3MBTL1

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-20190055193-A1 High-Solubility Thioether Quinones U.S. DEPARTMENT OF ENERGY 2019-02-21 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-20190055193-A1 High-Solubility Thioether Quinones SQOR, TST, NDUFS3 FFAR1 2475/4885MAPT 3999/4885MAPK1 1093/4885

“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.