SCHEMBL6092963

SCHEMBL6092963

CCCCC(=O)Nc1c(C(=O)O)n(Cc2cccc(Cl)c2)c2cc(-c3ccccc3OC(C)C)ccc12

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
GSK3B P49841 2/20 0.42
THRB P10828 1/20 0.42
RXFP1 Q9HBX9 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PLA2G1B P04054 1/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
PPARG P37231 1/20 0.36
CES2 O00748 1/20 0.36
PTGES O14684 1/20 0.36
YWHAH Q04917 1/20 0.36

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
SCHEMBL6091691 0.88 TP53 (0.44) TP53GSK3BTHRBPTGESYWHAH
SCHEMBL6091172 0.88 TP53 (0.41) TP53GSK3BTHRBPPARGPTGES
SCHEMBL6090090 0.87 PPARG (0.41) TP53PLA2G1BHTTL3MBTL1ATG4B
SCHEMBL5747009 0.87 THRB (0.45) TP53GSK3BTHRBPPARG
SCHEMBL5739167 0.83 PTGES (0.46) PLA2G1BHTTL3MBTL1ATG4BPTGES
SCHEMBL6089685 0.82 GRIN1 (0.44) TP53GSK3BTHRBPTGES
SCHEMBL6089609 0.80 PTGES (0.42) TP53GSK3BTHRBPTGES
SCHEMBL6091802 0.78 PTGES (0.50) TP53PPARGPTGESYWHAH
SCHEMBL6091726 0.77 YWHAH (0.41) TP53PPARGPTGESYWHAH
SCHEMBL6090079 0.77 TP53 (0.42) TP53PPARGPTGESYWHAH

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-20060160879-A1 Indoles useful in the treatment of inflammation BIOLIPOX AB (SE) 2006-07-20 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-20060160879-A1 Indoles useful in the treatment of inflammation IDO1, PTGS1, IDO2 TP53 2032/4885GSK3B 1452/4885THRB 1146/4885

“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.