SCHEMBL3575288

SCHEMBL3575288

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

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
THRB P10828 2/20 0.43
POLB P06746 1/20 0.41
MAPT P10636 6/20 0.40
TP53 P04637 5/20 0.40
ATM Q13315 1/20 0.39
NPSR1 Q6W5P4 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PPARG P37231 1/20 0.38
NCOA2 Q15596 1/20 0.38
NCOA1 Q15788 1/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
PKM P14618 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
SCHEMBL4698400 0.93 PTGES (0.45) PTGESSMN1; SMN2THRBPOLBMAPT
SCHEMBL3578280 0.86 PTGES (0.53) PTGESALDH1A1
SCHEMBL4698539 0.84 PTGES (0.41) PTGESSMN1; SMN2THRBPOLBMAPT
SCHEMBL3007903 0.83 PTGES (0.43) PTGESSMN1; SMN2THRBPOLBMAPT
SCHEMBL4923368 0.83 PPARG (0.45) PTGESSMN1; SMN2THRBPOLBMAPT
SCHEMBL4702525 0.82 PTGES (0.40) PTGESSMN1; SMN2THRBPOLBMAPT
SCHEMBL4021254 0.82 PTGES (0.59) PTGESSMN1; SMN2THRBPOLBMAPT
SCHEMBL3007173 0.82 MAPT (0.46) SMN1; SMN2THRBPOLBMAPTTP53
SCHEMBL4698398 0.82 PTGES (0.55) PTGESSMN1; SMN2THRBPOLBMAPT
SCHEMBL335076 0.81 SMN1; SMN2 (0.50) SMN1; SMN2THRBPOLBMAPTTP53

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 7 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-1778633-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-12-03 EP disclosed
EP-1778632-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2008-08-20 EP disclosed
US-20080188473-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2008-08-07 US disclosed
US-20070287715-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2007-12-13 US disclosed
EP-1778633-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-05-02 EP disclosed
WO-2005123674-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-12-29 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 (2 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 3/4885SMN1; SMN2 4318/4885THRB 1086/4885
US-20080188473-A1 Indoles Useful in the Treatment of Inflammation IDO1, PTGS1, PTGER1 PTGES 4/4885SMN1; SMN2 4126/4885THRB 1094/4885

“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.