SCHEMBL4803634

SCHEMBL4803634

CC(=O)NCc1ccc(Oc2ccc3c(c2)S(=O)(=O)NC2CCCN32)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 1/20 0.47
GRIA2 P42262 9/20 0.42
MMP2 P08253 1/20 0.40
MMP8 P22894 1/20 0.40
HRH3 Q9Y5N1 3/20 0.38
THRB P10828 1/20 0.38
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 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
SCHEMBL4807850 0.92 ALDH1A1 (0.45) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL4800665 0.88 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL4806754 0.85 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL4810196 0.84 HPGD (0.52) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL5768368 0.83 KDM4E (0.53) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL5640361 0.83 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL5643891 0.82 HPGD (0.46) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL5640743 0.82 HPGD (0.47) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL5620076 0.82 GRIA2 (0.61) KDM4EALDH1A1HPGDHSD17B10GRIA2
SCHEMBL5621088 0.82 GRIA2 (0.61) KDM4EALDH1A1HPGDHSD17B10GRIA2

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-7423034-B2 Benzothiazine and benzothiadiazine compounds LES LABORATOIRES SERVIER (FR) 2008-09-09 US disclosed
US-20070249594-A1 Benzothiazine and benzothiadiazine compounds DESOS PATRICE 2007-10-25 US disclosed
US-7253162-B2 Benzothiazine and benzothiadiazine compounds LES LABORATOIRES SERVIER (FR) 2007-08-07 US disclosed
EP-1486503-B1 Derivatives of benzothiazine and benzothiadiazine, procedure for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2006-11-02 EP disclosed
US-20040254161-A1 New benzothiazine and benzothiadiazine compounds LES LABORATOIRES SERVIER (FR) 2004-12-16 US disclosed
EP-1486503-A1 Derivatives of benzothiazine and benzothiadiazine, procedure for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2004-12-15 EP 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-20070249594-A1 Benzothiazine and benzothiadiazine compounds GRIA4, GABRA4, GRIK4 KDM4E 2782/4885ALDH1A1 505/4885HPGD 1165/4885
US-20040254161-A1 New benzothiazine and benzothiadiazine compounds NR4A1, NR4A3, NR4A2 KDM4E 1665/4885ALDH1A1 775/4885HPGD 1807/4885

“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.