SCHEMBL3567412

SCHEMBL3567412

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
ATM Q13315 1/20 0.42
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ELANE P08246 4/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
THRB P10828 1/20 0.38
TP53 P04637 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PTGS2 P35354 1/20 0.37
CASP3 P42574 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRB2 P47870 1/20 0.36
KDM4E B2RXH2 1/20 0.36
SCN1A P35498 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 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
SCHEMBL3577723 0.89 MAOA (0.39) MAPTMAOAMAOBSMN1; SMN2THRB
SCHEMBL3575302 0.87 THRB (0.39) MAPTMAOAMAOBSMN1; SMN2THRB
SCHEMBL4701387 0.86 EPHX2 (0.36) MAOB
SCHEMBL4922812 0.84 THRB (0.41) MAPTMAOAMAOBSMN1; SMN2THRB
SCHEMBL4918631 0.83 EPHX2 (0.47) ELANE
SCHEMBL3570481 0.83 UCHL1 (0.39) MAPTMAOAMAOBSMN1; SMN2THRB
SCHEMBL3571150 0.82 MAPT (0.45) MAPTATMELANELMNASMN1; SMN2
SCHEMBL3573660 0.82 FAAH (0.40) MAPTMAOAMAOBPTGS2
SCHEMBL3570957 0.82 MAOA (0.43) MAPTATMMAOAMAOBELANE
SCHEMBL3569793 0.79 GCK (0.40) MAPTSMN1; SMN2THRBKDM4E

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 6 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-20080249091-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2008-10-09 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 (2 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 MAPT 3268/4885ATM 3830/4885MAOA 153/4885
US-20080249091-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, ARG1 MAPT 89/4885ATM 2865/4885MAOA 142/4885

“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.