SCHEMBL2884659

SCHEMBL2884659

O=C(O)/C=C/c1cccc2ccn(Cc3ccc4ccccc4c3)c12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGER3 P43115 9/20 0.62
▸ PTGDR Q13258 2/20 0.57
▸ TBXA2R P21731 1/20 0.57
▸ PTGER4 P35408 1/20 0.57
▸ PTGFR P43088 1/20 0.57
▸ PTGER2 P43116 1/20 0.57
▸ APP P05067 3/20 0.50
▸ SNCA P37840 2/20 0.50
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ CYP2D6 P10635 1/20 0.47
▸ HDAC3 O15379 2/20 0.44
▸ HDAC4 P56524 2/20 0.44
▸ HDAC1 Q13547 2/20 0.44
▸ HDAC7 Q8WUI4 2/20 0.44
▸ HDAC2 Q92769 2/20 0.44
▸ HDAC10 Q969S8 2/20 0.44
▸ HDAC11 Q96DB2 2/20 0.44
▸ HDAC8 Q9BY41 2/20 0.44
▸ HDAC6 Q9UBN7 2/20 0.44

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
SCHEMBL2884663 1.00 PTGER3 (0.62) PTGER3PTGDRTBXA2RPTGER4PTGFR
SCHEMBL13020377 0.82 HDAC3 (0.61) PTGER3PTGDRTBXA2RPTGER4PTGFR
SCHEMBL1137524 0.81 PTGER3 (0.52) PTGER3PTGDRTBXA2RPTGER4PTGFR
SCHEMBL1137528 0.81 PTGER3 (0.52) PTGER3PTGDRTBXA2RPTGER4PTGFR
SCHEMBL7712237 0.76 PTGER3 (0.56) PTGER3PTGER4PTGER2APPSNCA
SCHEMBL1137928 0.75 CYP2C9 (0.52) PTGER3PTGDRTBXA2RPTGER4PTGFR
SCHEMBL1137925 0.75 CYP2C9 (0.52) PTGER3PTGDRTBXA2RPTGER4PTGFR
SCHEMBL2884649 0.75 PTGER4 (0.55) PTGER3PTGER4PTGER2CYP2C9
SCHEMBL1137334 0.74 PTGER3 (0.66) PTGER3PTGDRTBXA2RPTGER4PTGFR
SCHEMBL1137339 0.74 PTGER3 (0.66) PTGER3PTGDRTBXA2RPTGER4PTGFR

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 19/4885PTGDR 3/4885TBXA2R 25/4885

“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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