SCHEMBL3574897

SCHEMBL3574897

O=C(O)c1cc2cc(-c3ncc(-c4ccccn4)cn3)ccc2n1-c1ccc(OC2CCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.40
PDE4A P27815 2/20 0.39
FFAR4 Q5NUL3 2/20 0.38
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
ABL1 P00519 1/20 0.36
HRH3 Q9Y5N1 6/20 0.36
TAOK1 Q7L7X3 1/20 0.35
KDM2B Q8NHM5 1/20 0.35
GRM5 P41594 2/20 0.35
KCNH2 Q12809 2/20 0.34
PDE4B Q07343 1/20 0.34
CHRM2 P08172 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
SCHEMBL3569096 0.86 PTGES (0.43) PTGESPDE4AFFAR4ALDH1A1TSHR
SCHEMBL27677014 0.76 PDE4A (0.38) PDE4AFFAR4ALDH1A1TAOK1PDE4B
SCHEMBL3578441 0.75 PTGES (0.47) PTGESKCNH2
SCHEMBL3578255 0.75 PTGES (0.69) PTGESPDE4AALDH1A1TSHRHRH3
SCHEMBL3579044 0.75 MAPT (0.39) PTGESALDH1A1TSHR
SCHEMBL4697234 0.73 MAP4K4 (0.53) PTGESPDE4AALDH1A1TSHRKCNH2
SCHEMBL3576474 0.71 PTGES (0.71) PTGESALDH1A1TSHRHRH3KCNH2
SCHEMBL4914710 0.70 ALDH1A1 (0.38) PTGESALDH1A1TSHRHRH3KCNH2
SCHEMBL4099631 0.69 MAP4K4 (0.39) PTGESFFAR4HRH3KCNH2
SCHEMBL4923166 0.68 EPHX2 (0.39) PTGESALDH1A1TSHRHRH3

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-7705023-B2 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2010-04-27 US disclosed
EP-1778632-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-08-20 EP disclosed
US-20070287715-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2007-12-13 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-20070287715-A1 Indoles Useful in the Treatment of Inflammation PTGS1, IDO1, PTGES PTGES 3/4885PDE4A 1851/4885FFAR4 821/4885

“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.