SCHEMBL3580796

SCHEMBL3580796

CCOC(=O)c1c(Cl)c2cc(-c3ccc(OC(C)C)cc3)ccc2n1-c1ccc(OC(C)C)nc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.37
TP53 P04637 5/20 0.36
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
THRB P10828 1/20 0.36
POLB P06746 1/20 0.36
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
PTGDR Q13258 1/20 0.34
PTPN11 Q06124 1/20 0.34
PTGER4 P35408 1/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
NCOA1 Q15788 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34

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
SCHEMBL3580289 0.88 PTGES (0.43) PTGESACACBACACAPTGDR
SCHEMBL3577515 0.81 PTGES (0.53) PTGESTP53MAPTSMN1; SMN2POLB
SCHEMBL3013050 0.80 MAPT (0.49) PTGESTP53MAPTSMN1; SMN2THRB
SCHEMBL3006452 0.80 KDM4E (0.39) PTGESTP53MAPTSMN1; SMN2THRB
SCHEMBL3011861 0.80 MEN1 (0.51) TP53MAPTSMN1; SMN2THRBPOLB
SCHEMBL3577781 0.80 SMN1; SMN2 (0.42) TP53MAPTSMN1; SMN2THRBPOLB
SCHEMBL3571150 0.80 MAPT (0.45) TP53MAPTSMN1; SMN2THRBPOLB
SCHEMBL3575288 0.78 PTGES (0.44) PTGESTP53MAPTSMN1; SMN2THRB
SCHEMBL3573520 0.78 SMN1; SMN2 (0.43) TP53MAPTSMN1; SMN2THRBPOLB
SCHEMBL4026661 0.77 F2RL3 (0.40) PTGESMAPTPTPN11PPARG

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 3/4885TP53 2179/4885MAPT 3268/4885

“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.