SCHEMBL4097225

SCHEMBL4097225

CCOC(=O)c1cc2cc(Oc3cccc(C(F)(F)F)c3)ncc2n1-c1ccc(OC(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
KDR P35968 1/20 0.43
PPARG P37231 3/20 0.42
PPARA Q07869 2/20 0.42
RAB9A P51151 1/20 0.41
ATM Q13315 1/20 0.41
MAPT P10636 3/20 0.40
PTGES O14684 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SCN9A Q15858 2/20 0.39
GAA P10253 2/20 0.39
MAPK1 P28482 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL4095174 0.89 PTGES (0.51) PPARGPPARARAB9AMAPTPTGES
SCHEMBL4228507 0.85 SCN9A (0.48) PTGESSCN9AMAPK1
SCHEMBL4102319 0.85 KDM4E (0.46) KDM4EKDRPPARGPPARAATM
SCHEMBL3009731 0.80 PTGES (0.52) PPARGPPARAMAPTPTGESPOLB
SCHEMBL4920933 0.79 PTGES (0.48) MAPTPTGESPOLBSMN1; SMN2GAA
SCHEMBL4924224 0.77 PLA2G10 (0.49) PPARGPTGES
SCHEMBL3568886 0.77 PTGES (0.51) KDM4EMAPTPTGESL3MBTL1ALDH1A1
SCHEMBL3571641 0.77 PTGES (0.53) KDM4ERAB9AMAPTPTGESL3MBTL1
SCHEMBL4921606 0.77 PTGES (0.61) PPARGPPARAPTGES
SCHEMBL4095050 0.76 PTGES (0.48) PPARGPPARAPTGESALDH1A1

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-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-19 US disclosed
EP-1841766-A1 PYRROLOPYRIDINES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077401-A1 PYRROLOPYRIDINES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 WO 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-20090048285-A1 Pyrrolopyridines Useful in the Treatment of Inflammation PYCR1, ARG2, ARG1 KDM4E 1407/4885KDR 1491/4885PPARG 1316/4885

“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.