SCHEMBL7583941

SCHEMBL7583941

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

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.41
PTGIR P43119 9/20 0.40
DHODH Q02127 2/20 0.38
PTGDR Q13258 4/20 0.37
PKM P14618 1/20 0.35
PPARD Q03181 2/20 0.35
FFAR1 O14842 1/20 0.35
PTGER2 P43116 2/20 0.34

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
SCHEMBL7555836 0.98 PTGIR (0.41) PTGDR2PTGIRDHODHPTGDRPKM
SCHEMBL7523179 0.92 PTGIR (0.40) PTGDR2PTGIRDHODHPTGDRPPARD
SCHEMBL7528277 0.92 PTGDR2 (0.41) PTGDR2PTGIRDHODHPTGDRPPARD
SCHEMBL7519310 0.91 PTGIR (0.43) PTGIRPTGDR
SCHEMBL7522033 0.88 PTGIR (0.41) PTGDR2PTGIRPTGDRPPARD
SCHEMBL7526342 0.88 PTGIR (0.41) PTGDR2PTGIRPTGDR
SCHEMBL7517341 0.87 PTGDR2 (0.39) PTGDR2PTGIRPPARD
SCHEMBL7518608 0.86 PTGIR (0.40) PTGDR2PTGIRPTGDR
SCHEMBL7523906 0.86 PTGIR (0.39) PTGIRDHODHPTGDRFFAR1
SCHEMBL7524431 0.86 PTGIR (0.40) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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.