SCHEMBL27018581

SCHEMBL27018581

C/C(=C/c1ccccc1)OS(=O)(=O)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ FBP1 P09467 1/20 0.40
▸ RECQL P46063 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MTNR1A P48039 2/20 0.37
▸ MTNR1B P49286 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ PTGS2 P35354 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ GLA P06280 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4197382 0.85 CYP2C9 (0.46) AKR1C3ALDH1A1HTTPTGS2
SCHEMBL6023595 0.79 AKR1C3 (0.43) AKR1C3ALDH1A1TSHRMEN1KMT2A
SCHEMBL15417652 0.77 — —
Hydrogen Sulfide SCHEMBL23215080 0.77 AKR1C1 (0.40) AKR1C3ALDH1A1TSHRMEN1KMT2A
SCHEMBL12785465 0.73 — —
SCHEMBL28903785 0.71 ALDH1A1 (0.52) AKR1C3ALDH1A1TSHRFBP1RECQL
SCHEMBL756714 0.71 ALDH1A1 (0.52) AKR1C3ALDH1A1TSHRFBP1RECQL
SCHEMBL2201468 0.71 AKR1C3 (0.39) AKR1C3ALDH1A1TSHRFBP1PTGS2
SCHEMBL28964265 0.70 ALDH1A1 (0.47) ALDH1A1MEN1KMT2ATDP1
SCHEMBL8333914 0.70 — —

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-20240018105-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS KINESID THERAPEUTICS, INC. (US) 2024-01-18 — — 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-20240018105-A1 TROPOLONE DERIVATIVES AND TAUTOMERS THEREOF FOR IRON REGULATION IN ANIMALS TXNRD2, TXNRD1, SDHB AKR1C3 835/4885ALDH1A1 848/4885TSHR 404/4885

“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.

Send feedback