SCHEMBL3574685

SCHEMBL3574685

O=C(O)c1cc2cc(-c3ccc(OC(F)(F)F)cc3)ccc2n1-c1ccc(OCC2CCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGES O14684 2/20 0.48
NTRK1 P04629 3/20 0.46
FFAR4 Q5NUL3 5/20 0.40
CHRNA7 P36544 1/20 0.40
CNR1 P21554 1/20 0.39
PARP15 Q460N3 2/20 0.38
PARP10 Q53GL7 2/20 0.38
PARP2 Q9UGN5 1/20 0.38
PTGER4 P35408 1/20 0.37
GCGR P47871 2/20 0.36
KDM1A O60341 1/20 0.36
MAOB P27338 1/20 0.36
GIPR P48546 1/20 0.36
S1PR1 P21453 1/20 0.36

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
SCHEMBL3582146 0.84 PTGES (0.56) PTGESNTRK1PTGER4GCGR
SCHEMBL3568117 0.82 PTGES (0.58) PTGESNTRK1PTGER4GCGR
SCHEMBL3584093 0.81 PTGES (0.59) PTGESNTRK1GCGR
SCHEMBL3578399 0.79 PTGES (0.74) PTGESNTRK1GCGR
SCHEMBL3575240 0.79 PTGES (0.76) PTGESNTRK1GCGR
SCHEMBL5244517 0.75 FFAR4 (0.41) FFAR4PARP15PARP10PARP2
SCHEMBL13802518 0.73 SRD5A2 (0.60) PTGESNTRK1
SCHEMBL13802520 0.73 ALDH1A1 (0.67) PTGESNTRK1
SCHEMBL3578255 0.70 PTGES (0.69) PTGESGCGR
SCHEMBL3576474 0.70 PTGES (0.71) PTGES

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 2 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
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 3/4885NTRK1 3082/4885FFAR4 821/4885

“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.