SCHEMBL6090135

SCHEMBL6090135

COc1ccc(CCC(=O)Nc2c(C(=O)O)n(Cc3cccc(Cl)c3)c3cc(-c4cc(F)cc(F)c4)ccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.46
POLB P06746 2/20 0.46
YWHAH Q04917 2/20 0.42
MAPT P10636 3/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2B Q13224 1/20 0.41
PTGES O14684 1/20 0.41
PLA2G2A P14555 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
SCHEMBL6089633 0.92 TP53 (0.48) TP53POLBYWHAHMAPTGRIN1
SCHEMBL6091385 0.91 TP53 (0.43) TP53POLBYWHAHMAPTGRIN1
SCHEMBL6090994 0.88 TP53 (0.46) TP53POLBYWHAHMAPTGRIN1
SCHEMBL6089685 0.86 GRIN1 (0.44) TP53POLBGRIN1GRIN2BPTGES
SCHEMBL6090341 0.85 TP53 (0.43) TP53POLBYWHAHGRIN1GRIN2B
SCHEMBL6090737 0.81 GRIN1 (0.45) TP53POLBMAPTGRIN1GRIN2B
SCHEMBL6091457 0.81 GRIN1 (0.41) TP53POLBMAPTGRIN1GRIN2B
SCHEMBL6091003 0.81 MAPK1 (0.41) TP53POLBMAPTGRIN1GRIN2B
SCHEMBL6091176 0.80 PTGES (0.43) TP53POLBYWHAHMAPTGRIN1
SCHEMBL6093252 0.80 GRIN1 (0.45) TP53POLBMAPTGRIN1GRIN2B

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 2032/4885POLB 3825/4885YWHAH 521/4885

“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.