SCHEMBL7526342

SCHEMBL7526342

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

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 7/20 0.41
PTGDR2 Q9Y5Y4 4/20 0.39
PTGDR Q13258 2/20 0.38
ADRB3 P13945 6/20 0.37
ADRB1 P08588 4/20 0.36
ADRB2 P07550 3/20 0.36
PLA2G1B P04054 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
PPARA Q07869 1/20 0.34
TBXA2R P21731 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 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
SCHEMBL7524431 0.93 PTGIR (0.40) PTGIRPTGDR2PTGDRTBXA2R
SCHEMBL7519310 0.93 PTGIR (0.43) PTGIRPTGDRTBXA2R
SCHEMBL7522740 0.91 PTGIR (0.37) PTGIRPTGDR2PTGDRPPARA
SCHEMBL7522033 0.90 PTGIR (0.41) PTGIRPTGDR2PTGDRTBXA2R
SCHEMBL7555836 0.90 PTGIR (0.41) PTGIRPTGDR2PTGDRTBXA2R
SCHEMBL7518608 0.89 PTGIR (0.40) PTGIRPTGDR2PTGDRL3MBTL1TBXA2R
SCHEMBL7523179 0.89 PTGIR (0.40) PTGIRPTGDR2PTGDRTBXA2R
SCHEMBL7523249 0.88 PTGIR (0.39) PTGIRPTGDR2PTGDRTBXA2R
SCHEMBL7583941 0.88 PTGDR2 (0.41) PTGIRPTGDR2PTGDR
SCHEMBL7517341 0.87 PTGDR2 (0.39) PTGIRPTGDR2PPARA

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 10/4885PTGDR 3/4885

“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.