SCHEMBL23312355

SCHEMBL23312355

CCC(C)c1ccc(S(C)(=O)=O)cc1F

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.39
HTT P42858 1/20 0.37
PTGS1 P23219 3/20 0.36
KIF11 P52732 1/20 0.36
AKR1C3 P42330 2/20 0.36
AKR1C2 P52895 2/20 0.36

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
SCHEMBL10105627 0.82 PTGS2 (0.43) PTGS2KIF11AKR1C3AKR1C2
SCHEMBL13055320 0.80 LMNA (0.42) PTGS2PTGS1
SCHEMBL13995391 0.80 KIF11 (0.43) PTGS2PTGS1KIF11
SCHEMBL10192308 0.77 KIF11 (0.40) PTGS2KIF11AKR1C3AKR1C2
SCHEMBL25974967 0.74 MC4R (0.41)
SCHEMBL12686634 0.74 MC4R (0.41)
SCHEMBL12686652 0.74 MC4R (0.41)
SCHEMBL16437813 0.73 PTGS2 (0.47) PTGS2PTGS1KIF11
SCHEMBL13813774 0.73 TSHR (0.39)
SCHEMBL10152122 0.72 RORC (0.42) HTTKIF11

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-20210122713-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES ACADIA PHARMACEUTICALS INC. (US) 2021-04-29 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-20210122713-A1 COMPOUNDS, SALTS THEREOF AND METHODS FOR TREATMENT OF DISEASES SLC10A1, VHL, CYP11B2 PTGS2 1309/4885HTT 320/4885PTGS1 1321/4885

“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.