SCHEMBL3569007

SCHEMBL3569007

CC(C)Oc1ccc2cc(-n3c(C(=O)O)cc4cc(-c5ccc(C(C)(C)C)cc5)ccc43)ccc2c1

nearest known ligand 0.88

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.88
CCR9 P51686 5/20 0.41
LDHA P00338 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
MCL1 Q07820 4/20 0.38
BCL2 P10415 3/20 0.37
MDM2 Q00987 3/20 0.37
NR1H4 Q96RI1 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
PTPN5 P54829 1/20 0.36
TSHR P16473 1/20 0.36
FFAR4 Q5NUL3 1/20 0.35

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
SCHEMBL3581438 0.94 PTGES (1.00) PTGESCCR9LDHAALDH1A1KDM4E
SCHEMBL3571596 0.86 PTGES (0.72) PTGESLDHAALDH1A1RXRARXRB
SCHEMBL3574806 0.86 PTGES (0.85) PTGESLDHAALDH1A1KDM4EHPGD
SCHEMBL4925712 0.85 PTGES (0.81) PTGESCCR9ALDH1A1KDM4EHPGD
SCHEMBL3570895 0.84 PTGES (0.83) PTGESLDHAALDH1A1RXRARXRB
SCHEMBL3574571 0.82 PTGES (0.69) PTGESLDHAALDH1A1HPGD
SCHEMBL3579996 0.82 PTGES (0.78) PTGESLDHAALDH1A1KDM4EHPGD
SCHEMBL3578399 0.81 PTGES (0.74) PTGESCCR9LDHAALDH1A1NR1H4
SCHEMBL3578959 0.81 PTGES (0.77) PTGESSMN1; SMN2NR1H4PPARGPPARA
SCHEMBL3574862 0.81 PTGES (0.77) PTGESLDHAALDH1A1KDM4EHPGD

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.