SCHEMBL3009934

SCHEMBL3009934

CCOC(=O)CCc1cc2cc(-c3ccc(C(F)(F)F)cn3)ccc2n1-c1ccc(OC(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.44
MLYCD O95822 5/20 0.37
POLB P06746 1/20 0.35
SCN9A Q15858 3/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PPARD Q03181 1/20 0.34
GCK P35557 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPARG P37231 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33

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
SCHEMBL2997930 0.90 PTGES (0.49) PTGESMLYCDPPARDGCKPPARG
SCHEMBL3571641 0.85 PTGES (0.53) PTGESMLYCDPOLBSCN9AKDM4E
SCHEMBL333994 0.83 PTGES (0.37) PTGESPOLBSCN9AKDM4EL3MBTL1
SCHEMBL3582187 0.81 PTGES (0.67) PTGESPPARDPPARG
SCHEMBL3001790 0.78 KDM4E (0.40) PTGESPOLBSCN9AKDM4EL3MBTL1
SCHEMBL2997500 0.78 KDM4E (0.40) PTGESPOLBSCN9AKDM4EL3MBTL1
SCHEMBL3008051 0.77 KDM4E (0.39) PTGESPOLBSCN9AKDM4EL3MBTL1
SCHEMBL3006452 0.77 KDM4E (0.39) PTGESMLYCDPOLBSCN9AKDM4E
SCHEMBL3001004 0.77 KDM4E (0.39) PTGESPOLBSCN9AKDM4EL3MBTL1
SCHEMBL3000835 0.77 KMT2A (0.43) PTGESKDM4EL3MBTL1SMN1; SMN2PPARG

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-20100197687-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2010-08-05 US disclosed
EP-1841736-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077367-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMATION BIOLIPOX AB (SE) 2006-07-27 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-20100197687-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, TPH1 PTGES 33/4885MLYCD 1376/4885POLB 4630/4885

“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.