SCHEMBL3575240

SCHEMBL3575240

CC(C)Oc1ccc(-n2c(C(=O)O)cc3cc(-c4ccc(OC(F)(F)F)cc4)ccc32)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.76
NTRK1 P04629 2/20 0.43
MCL1 Q07820 2/20 0.41
GCGR P47871 2/20 0.41
PLA2G10 O15496 3/20 0.40
PLA2G2A P14555 3/20 0.40
PLA2G5 P39877 3/20 0.40
AURKA O14965 1/20 0.40
TPX2 Q9ULW0 1/20 0.40
LDHA P00338 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
PPARD Q03181 2/20 0.38
PPARA Q07869 1/20 0.38
PTPN5 P54829 1/20 0.38
BCL2 P10415 1/20 0.38
MDM2 Q00987 1/20 0.38
AKR1C2 P52895 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
SCHEMBL3574806 0.91 PTGES (0.85) PTGESMCL1LDHAALDH1A1TSHR
SCHEMBL4926021 0.90 PTGES (0.61) PTGESNTRK1MCL1GCGRPLA2G10
SCHEMBL3570895 0.90 PTGES (0.83) PTGESMCL1GCGRLDHAALDH1A1
SCHEMBL3584093 0.88 PTGES (0.59) PTGESNTRK1GCGRAURKATPX2
SCHEMBL3568117 0.87 PTGES (0.58) PTGESNTRK1MCL1GCGRPLA2G10
SCHEMBL3579996 0.87 PTGES (0.78) PTGESMCL1LDHAALDH1A1TSHR
SCHEMBL3578399 0.86 PTGES (0.74) PTGESNTRK1GCGRAURKATPX2
SCHEMBL3581438 0.86 PTGES (1.00) PTGESMCL1LDHAALDH1A1TSHR
SCHEMBL3574862 0.86 PTGES (0.77) PTGESMCL1LDHAALDH1A1TSHR
SCHEMBL3582146 0.85 PTGES (0.56) PTGESNTRK1GCGRAURKATPX2

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 3/4885NTRK1 3082/4885MCL1 1274/4885

“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.