SCHEMBL3577508

SCHEMBL3577508

CC(C)(C)c1ccc(-c2ccc3c(c2)cc(C(=O)O)n3-c2cc(Cl)cc(Cl)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.66
CCR9 P51686 11/20 0.47
LDHA P00338 1/20 0.45
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
CCR2 P41597 1/20 0.41
GCGR P47871 1/20 0.40
ACLY P53396 1/20 0.39

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
SCHEMBL3567316 0.92 PTGES (0.71) PTGESCCR9LDHAAKR1C2AKR1C1
SCHEMBL3569788 0.84 PTGES (0.71) PTGESCCR9LDHAALDH1A1TSHR
SCHEMBL3573984 0.81 PTGES (0.67) PTGESLDHAALDH1A1TSHRCCR2
SCHEMBL3581438 0.80 PTGES (1.00) PTGESCCR9LDHAALDH1A1TSHR
SCHEMBL3578399 0.80 PTGES (0.74) PTGESCCR9LDHAALDH1A1TSHR
SCHEMBL3584722 0.80 PTGES (0.65) PTGESLDHAALDH1A1TSHR
SCHEMBL3584720 0.80 PTGES (0.65) PTGESLDHAALDH1A1TSHR
SCHEMBL3579604 0.78 PTGES (0.63) PTGESLDHAALDH1A1TSHRGCGR
SCHEMBL3567571 0.78 PTGES (0.71) PTGESCCR9LDHAALDH1A1TSHR
SCHEMBL3569007 0.78 PTGES (0.88) PTGESCCR9LDHAALDH1A1TSHR

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 3/4885CCR9 1323/4885LDHA 2118/4885

“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.