SCHEMBL3575302

SCHEMBL3575302

CCOC(=O)c1c(Cl)c2cc(B(O)O)ccc2n1-c1ccc(OC2CCCC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
TP53 P04637 5/20 0.38
MAPT P10636 5/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
PTGS2 P35354 1/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 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
SCHEMBL3567412 0.87 MAPT (0.42) THRBSMN1; SMN2MAOAMAOBTP53
SCHEMBL3577723 0.87 MAOA (0.39) THRBSMN1; SMN2MAOAMAOBTP53
SCHEMBL3573520 0.83 SMN1; SMN2 (0.43) THRBSMN1; SMN2TP53MAPTKDM4E
SCHEMBL4922812 0.82 THRB (0.41) THRBSMN1; SMN2MAOAMAOBTP53
SCHEMBL4918631 0.82 EPHX2 (0.47)
SCHEMBL3570481 0.81 UCHL1 (0.39) THRBSMN1; SMN2MAOAMAOBTP53
SCHEMBL3573660 0.81 FAAH (0.40) MAOAMAOBMAPTMAPK1PTGS2
SCHEMBL3569793 0.77 GCK (0.40) THRBSMN1; SMN2MAPTKDM4EKCNH2
SCHEMBL4924328 0.74 MAOA (0.35) THRBSMN1; SMN2MAOAMAOBTP53
SCHEMBL3577481 0.73 EPHX2 (0.36) MAOBHTTKMT2AMEN1KCNH2

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 THRB 1086/4885SMN1; SMN2 4318/4885MAOA 153/4885

“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.