SCHEMBL333732

SCHEMBL333732

CCOC(=O)Cc1c(C(=O)OCC)c2cc(Oc3cccc(Cl)c3)ccc2n1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.49
ALOX5 P09917 2/20 0.44
TP53 P04637 4/20 0.44
THRB P10828 2/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
ELANE P08246 2/20 0.42
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
USP14 P54578 1/20 0.41

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
SCHEMBL333819 0.93 ALOX5 (0.45) PTGESALOX5TP53THRBMAPT
SCHEMBL333979 0.90 PTGES (0.55) PTGESTP53THRBMAPTSMN1; SMN2
SCHEMBL334059 0.90 ALOX5 (0.45) PTGESALOX5TP53THRBMAPT
SCHEMBL334103 0.89 PTGES (0.50) PTGESALOX5TP53THRBMAPT
SCHEMBL333935 0.88 ALOX5 (0.52) ALOX5TP53THRBMAPTSMN1; SMN2
SCHEMBL334106 0.88 PTGES (0.49) PTGESALOX5TP53THRBMAPT
SCHEMBL333680 0.87 PTGES (0.45) PTGESALOX5TP53THRBMAPT
SCHEMBL333584 0.87 PTGES (0.49) PTGESALOX5TP53THRBMAPT
SCHEMBL333849 0.87 ALOX5 (0.46) ALOX5TP53THRBMAPTSMN1; SMN2
SCHEMBL333972 0.87 TP53 (0.45) PTGESALOX5TP53THRBMAPT

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-8097623-B2 1-Aryl-or heteroaryl-3-aryl-or heteroarylindole-2-carboxylic acids or esters: e.g., 5-(4-tert-Butylphenyl)-1,3-bis(4-isopropoxyphenyl)-indole-2-carboxylic acid; inhibition of the activity of microsomal prostaglandin E synthase-1, leukotriene C4 and/or 5-lipoxygenase-activating protein; analgesics BIOLIPOX AB (SE) 2012-01-17 US disclosed
EP-1841735-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2011-03-09 EP disclosed
US-20090076004-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-03-19 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-20090076004-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG PTGES 34/4885ALOX5 1146/4885TP53 738/4885

“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.