SCHEMBL3581409

SCHEMBL3581409

CCOC(=O)c1cc2cc(-c3ccc(Cl)cc3)ccc2n1-c1ccc(OC(C)C)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.59
MAPK1 P28482 2/20 0.44
GABRA2 P47869 3/20 0.42
GABRB2 P47870 3/20 0.42
MCHR1 Q99705 1/20 0.42
P2RX3 P56373 1/20 0.41
NOD2 Q9HC29 1/20 0.41
NOD1 Q9Y239 1/20 0.41
CHRNA7 P36544 2/20 0.41
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 1/20 0.39
FAAH O00519 1/20 0.39
MAPT P10636 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.38
IDO1 P14902 1/20 0.37

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
SCHEMBL3575712 0.95 PTGES (0.64) PTGESCHRNA7ALDH1A1KMT2AMAPT
SCHEMBL3578959 0.88 PTGES (0.77) PTGESKMT2AMAPT
SCHEMBL3574862 0.86 PTGES (0.77) PTGESMCHR1ALDH1A1KMT2AKDM4E
SCHEMBL3574312 0.85 PTGES (0.53) PTGESMCHR1ALDH1A1MAPTIDO1
SCHEMBL3577515 0.85 PTGES (0.53) PTGESMAPTIDO1
SCHEMBL3001458 0.84 PTGES (0.51) PTGESMAPK1ALDH1A1KMT2AMAPT
SCHEMBL3577805 0.84 PTGES (0.53) PTGESALDH1A1FAAHMAPTLMNA
SCHEMBL4224238 0.83 PTGES (0.45) PTGESMAPK1GABRA2GABRB2NOD2
SCHEMBL2997482 0.83 PTGES (0.50) PTGESALDH1A1KMT2AMAPTKDM4E
SCHEMBL3578734 0.83 PTGES (0.50) PTGESALDH1A1KMT2AMAPTNPSR1

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 5 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
EP-1778632-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-05-02 EP disclosed
WO-2005123673-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-12-29 WO 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 3/4885MAPK1 1991/4885GABRA2 3027/4885

“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.