SCHEMBL4228535

SCHEMBL4228535

CN(CC(=O)O)C(=O)c1cc2cc(-c3ccc(C(C)(C)C)cc3)ccc2n1-c1ccc(OC2CCCC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.53
GCGR P47871 2/20 0.34
ACACB O00763 2/20 0.33
APP P05067 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
NPC1L1 Q9UHC9 1/20 0.33
FFAR4 Q5NUL3 3/20 0.33
FFAR1 O14842 2/20 0.32
NPY1R P25929 1/20 0.32
NPY2R P49146 1/20 0.32

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
SCHEMBL3578255 0.87 PTGES (0.69) PTGESGCGRACACBAPPKDM4E
SCHEMBL3010108 0.85 PTGES (0.47) PTGESGCGRACACBAPPKDM4E
SCHEMBL4228938 0.84 PTGES (0.57) PTGESACACBAPPKDM4EMEN1
SCHEMBL4228521 0.84 PTGES (0.54) PTGESGCGRACACBKDM4EMEN1
SCHEMBL3576474 0.83 PTGES (0.71) PTGESACACBKDM4EALDH1A1HRH3
SCHEMBL3001562 0.83 PTGES (0.54) PTGESACACBMEN1KMT2ALMNA
SCHEMBL4228950 0.83 PTGES (0.52) PTGESGCGRLMNAMAPT
SCHEMBL3006124 0.81 PTGES (0.49) PTGESGCGRACACBKDM4EMEN1
SCHEMBL3005797 0.80 PTGES (0.47) PTGESGCGRACACBAPPKDM4E
SCHEMBL3572573 0.80 PTGES (0.56) PTGESACACBMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042949-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-12 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-20090042949-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG PTGES 28/4885GCGR 675/4885ACACB 3504/4885

“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.