SCHEMBL7555836

SCHEMBL7555836

O=C(O)COc1cccc2c1CCc1sc(SC(c3ccccc3)c3cccc(F)c3)nc1-2

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 12/20 0.41
PTGDR2 Q9Y5Y4 3/20 0.40
DHODH Q02127 2/20 0.39
PTGDR Q13258 4/20 0.38
PPARD Q03181 1/20 0.35
TBXA2R P21731 1/20 0.34
PKM P14618 1/20 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
SCHEMBL7583941 0.98 PTGDR2 (0.41) PTGIRPTGDR2DHODHPTGDRPPARD
SCHEMBL7523179 0.94 PTGIR (0.40) PTGIRPTGDR2DHODHPTGDRPPARD
SCHEMBL7519310 0.93 PTGIR (0.43) PTGIRPTGDRTBXA2R
SCHEMBL7528277 0.92 PTGDR2 (0.41) PTGIRPTGDR2DHODHPTGDRPPARD
SCHEMBL7526342 0.90 PTGIR (0.41) PTGIRPTGDR2PTGDRTBXA2R
SCHEMBL7522033 0.90 PTGIR (0.41) PTGIRPTGDR2PTGDRPPARDTBXA2R
SCHEMBL7517341 0.89 PTGDR2 (0.39) PTGIRPTGDR2PPARD
SCHEMBL7518608 0.89 PTGIR (0.40) PTGIRPTGDR2PTGDRTBXA2R
SCHEMBL7523906 0.88 PTGIR (0.39) PTGIRDHODHPTGDRTBXA2R
SCHEMBL7524431 0.88 PTGIR (0.40) PTGIRPTGDR2PTGDRPPARDTBXA2R

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 PTGIR 11/4885PTGDR2 10/4885DHODH 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.