SCHEMBL7582866

SCHEMBL7582866

O=C(O)COc1cccc2c1CCc1sc(S(=O)(=O)C(c3cccc(F)c3)c3cccc(F)c3)nc1-2

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.40
PTGIR P43119 11/20 0.39
DHODH Q02127 2/20 0.37
PTGDR Q13258 4/20 0.36
PKM P14618 1/20 0.36
FFAR1 O14842 1/20 0.34
PPARD Q03181 1/20 0.34
CTSA P10619 1/20 0.33

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
SCHEMBL7561846 0.98 DHODH (0.40) PTGDR2PTGIRDHODHPTGDRPKM
SCHEMBL7527902 0.92 PTGIR (0.39) PTGDR2PTGIRDHODHPTGDRPPARD
SCHEMBL7521984 0.92 PTGDR2 (0.40) PTGDR2PTGIRDHODHPTGDRPKM
SCHEMBL7520084 0.91 PTGIR (0.42) PTGIRDHODHPTGDR
SCHEMBL7523788 0.88 PTGIR (0.40) PTGDR2PTGIRPTGDRFFAR1PPARD
SCHEMBL7518867 0.88 PTGIR (0.40) PTGDR2PTGIRPTGDRPPARDCTSA
SCHEMBL7531170 0.88 PTGDR2 (0.38) PTGDR2PTGIRPTGDRPPARDCTSA
SCHEMBL7525454 0.86 PTGIR (0.38) PTGIRDHODHPTGDR
SCHEMBL7521207 0.86 PTGIR (0.39) PTGDR2PTGIRPTGDRCTSA
SCHEMBL7528910 0.86 PTGIR (0.39) PTGDR2PTGIRPTGDRPPARD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020006944-A1 Tricyclic compounds, their production and use OHKAWA SHIGENORI (JP) 2002-01-17 US claimed
US-6417213-B2 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-07-09 US disclosed
US-20020006944-A1 Tricyclic compounds, their production and use OHKAWA SHIGENORI (JP) 2002-01-17 US disclosed
US-6248766-B1 CARDIOVASCULAR DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-06-19 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-20020006944-A1 Tricyclic compounds, their production and use CNR1, PTGER1, PTGDR PTGDR2 10/4885PTGIR 11/4885DHODH 2808/4885

“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.