SCHEMBL4223256

SCHEMBL4223256

CCOC(=O)c1c(CC(=O)O)n(-c2ccc(OC(C)C)cc2)c2ccc(Oc3ccc(C(C)(C)C)cc3)cc12

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
THRB P10828 2/20 0.45
POLB P06746 1/20 0.43
TP53 P04637 5/20 0.43
MAPT P10636 3/20 0.43
PPARG P37231 2/20 0.42
PPARA Q07869 2/20 0.42
ATM Q13315 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42

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
SCHEMBL333940 0.93 PTGES (0.44) PTGESSMN1; SMN2THRBPOLBTP53
SCHEMBL335343 0.92 THRB (0.44) SMN1; SMN2THRBPOLBTP53MAPT
SCHEMBL334350 0.90 PTGES (0.52) PTGESPPARGPPARAMEN1KMT2A
SCHEMBL333812 0.85 ALOX5 (0.43) SMN1; SMN2THRBPOLBTP53MAPT
SCHEMBL4224224 0.85 SMN1; SMN2 (0.39) PTGESSMN1; SMN2THRBPOLBTP53
SCHEMBL334190 0.84 SCN9A (0.45) SMN1; SMN2THRBPOLBTP53MAPT
SCHEMBL333479 0.83 TP53 (0.52) SMN1; SMN2THRBPOLBTP53MAPT
SCHEMBL334099 0.83 ALOX5 (0.45) SMN1; SMN2THRBPOLBTP53MAPT
SCHEMBL333728 0.82 ALOX5 (0.45) PTGESSMN1; SMN2THRBTP53MAPT
SCHEMBL333467 0.82 SMN1; SMN2 (0.44) PTGESSMN1; SMN2THRBPOLBTP53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042949-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-02-12 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-20090042949-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG PTGES 28/4885SMN1; SMN2 3779/4885THRB 433/4885

“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.