SCHEMBL23665653

SCHEMBL23665653

CC(C)Cc1cccc(OS(=O)(=O)F)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.46
FDFT1 P37268 2/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CETP P11597 1/20 0.37
ADORA2B P29275 1/20 0.37
ALDH1A1 P00352 1/20 0.36
MGLL Q99685 1/20 0.36
GAA P10253 1/20 0.35
ACHE P22303 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
SCHEMBL4599115 0.85 TAAR1 (0.47) TAAR1FDFT1CA1CA2CA9
SCHEMBL23665817 0.84 FDFT1 (0.40) TAAR1FDFT1MGLL
SCHEMBL23665807 0.81 BCHE (0.46) CA2ALDH1A1
SCHEMBL687787 0.80 TAAR1 (0.43) TAAR1FDFT1CA1CA2CA9
SCHEMBL4599286 0.80 ALDH1A1 (0.48) TAAR1FDFT1ALDH1A1GAA
SCHEMBL22623364 0.80 ALDH1A1 (0.45) ALDH1A1
SCHEMBL16743905 0.80 CA1 (0.42) TAAR1FDFT1CA1CA2CA9
SCHEMBL6877653 0.79 TAAR1 (0.42) TAAR1FDFT1CA1CA2CA9
SCHEMBL32665337 0.78 CA1 (0.41) CA1CA2CA9CETPADORA2B
SCHEMBL4599792 0.78 ALDH1A1 (0.47) TAAR1ALDH1A1GAA

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
US-11739121-B2 EPHA2 agonists and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-08-29 US disclosed
US-11739121-B2 EPHA2 agonists and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-08-29 US disclosed
US-20210221843-A1 EPHA2 AGONISTS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-07-22 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 (2 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-11739121-B2 EPHA2 agonists and uses thereof EPHA2, EPHB2, EPHA6 TAAR1 1980/4885FDFT1 4220/4885CA1 4850/4885
US-20210221843-A1 EPHA2 AGONISTS AND USES THEREOF EPHA2, EPHB2, EPHA6 TAAR1 1962/4885FDFT1 4052/4885CA1 4845/4885

“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.