SCHEMBL4698400

SCHEMBL4698400

CCOC(=O)c1c(Br)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2n1-c1ccc(OC(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.45
PPARG P37231 4/20 0.40
PPARA Q07869 3/20 0.40
THRB P10828 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PTPN5 P54829 2/20 0.38
ALOX5 P09917 1/20 0.37
TP53 P04637 3/20 0.37
MAPT P10636 3/20 0.37
AKR1C3 P42330 2/20 0.37
AKR1C2 P52895 1/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL3575288 0.93 PTGES (0.44) PTGESPPARGTHRBSMN1; SMN2TP53
SCHEMBL4923368 0.91 PPARG (0.45) PTGESPPARGPPARATHRBSMN1; SMN2
SCHEMBL27698393 0.89 PPARG (0.40) PTGESPPARGPPARASMN1; SMN2ALOX5
SCHEMBL4700259 0.83 BTK (0.41) PTGESPPARGPPARATHRBSMN1; SMN2
SCHEMBL3007903 0.83 PTGES (0.43) PTGESPPARGPPARATHRBSMN1; SMN2
SCHEMBL4021254 0.82 PTGES (0.59) PTGESPPARGPPARATHRBSMN1; SMN2
SCHEMBL4698398 0.81 PTGES (0.55) PTGESPPARGPPARATHRBSMN1; SMN2
SCHEMBL3001790 0.80 KDM4E (0.40) PTGESPPARGPPARATHRBSMN1; SMN2
SCHEMBL3007687 0.80 PPARG (0.45) PTGESPPARGPPARATHRBSMN1; SMN2
SCHEMBL4918614 0.80 PPARG (0.47) PPARGPPARA

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
EP-1778633-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-12-03 EP disclosed
US-20080188473-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2008-08-07 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-20080188473-A1 Indoles Useful in the Treatment of Inflammation IDO1, PTGS1, PTGER1 PTGES 4/4885PPARG 753/4885PPARA 1228/4885

“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.