SCHEMBL2890761

SCHEMBL2890761

COC(=O)/C=C/c1cccc2c1N(Cc1ccc3ccccc3c1)C(=O)C2=O

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGER3 P43115 18/20 0.65
▸ CTRB1 P17538 1/20 0.47
▸ PTGER4 P35408 3/20 0.47
▸ CHRM5 P08912 1/20 0.46

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
SCHEMBL2890763 1.00 PTGER3 (0.65) PTGER3CTRB1PTGER4CHRM5
SCHEMBL1137339 0.87 PTGER3 (0.66) PTGER3CTRB1PTGER4
SCHEMBL1137334 0.87 PTGER3 (0.66) PTGER3CTRB1PTGER4
SCHEMBL5324748 0.83 PTGER3 (0.49) PTGER3PTGER4
SCHEMBL5324752 0.83 PTGER3 (0.49) PTGER3PTGER4
SCHEMBL12862610 0.78 PTGER3 (0.67) PTGER3
SCHEMBL1137514 0.77 PTGER3 (0.64) PTGER3
SCHEMBL1137513 0.77 PTGER3 (0.64) PTGER3
SCHEMBL13020380 0.77 HDAC3 (0.60) —
SCHEMBL2890111 0.72 PTGER3 (0.58) PTGER3CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714017-B2 for prostaglandin-mediated disorders; (E)-3-[1-(2,4-Dichloro-benzyl)-3,3-bis-hydroxymethyl-2-oxo-2,3-dihydro-1H-indol-7-yl]-acrylic acid DECODE GENETICS, EHF (IS) 2010-05-11 — — US disclosed
US-20060142355-A1 Carboxylic acid peri-substituted bicyclics for occlusive artery disease DECODE CHEMISTRY, INC. (US) 2006-06-29 — — 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-20060142355-A1 Carboxylic acid peri-substituted bicyclics for occlusive artery disease PTGIS, PTGIR, PTGDR PTGER3 19/4885CTRB1 1710/4885PTGER4 34/4885

“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.

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