SCHEMBL5183853

SCHEMBL5183853

COc1ccc2c(c1)S(=O)(=O)N=CN2C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
HTT P42858 1/20 0.43
GRIA2 P42262 4/20 0.41
THRB P10828 1/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
PKM P14618 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
SCHEMBL5412384 0.81 THRB (0.48) CYP1A2CYP2C9CYP2C19HTTGRIA2
SCHEMBL5487948 0.80 THRB (0.46) CYP1A2CYP2C9CYP2C19HTTGRIA2
SCHEMBL5485211 0.80 THRB (0.48) CYP1A2CYP2C9CYP2C19HTTGRIA2
SCHEMBL5487001 0.80 THRB (0.46) CYP1A2CYP2C9CYP2C19HTTGRIA2
SCHEMBL2179051 0.79 GRIA2 (0.45) CYP1A2CYP2C9CYP2C19HTTGRIA2
SCHEMBL5184948 0.67 SHMT2 (0.61) KDM4EMAPTALDH1A1CA12CA1
SCHEMBL4807734 0.66 KMT2A (0.56) HTTKDM4EMAPTALDH1A1HSD17B10
SCHEMBL5185245 0.65 GRIA2 (0.84) CYP1A2CYP2C9CYP2C19HTTGRIA2
SCHEMBL5485206 0.64 THRB (0.37) CYP1A2CYP2C9CYP2C19HTTGRIA2
SCHEMBL8799669 0.64 CYP1A2 (0.42) CYP1A2CYP2C9CYP2C19HTTGRIA2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253161-B2 Benzothiazine and benzothiadiazine derivatives method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2007-08-07 US disclosed
US-7250411-B2 Benzothiazine and benzothiadiazine compounds LES LABORATOIRES SERVIER (FR) 2007-07-31 US disclosed
EP-1456189-B1 BENZOTHIA(DIA)ZINE DERIVATIVES AND THEIR USE AS AMPA MODULATORS SERVIER LAB (FR) 2007-07-04 EP disclosed
US-20050124606-A1 Novel benzothiazine and benzothiadiazine derivatives method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2005-06-09 US disclosed
US-20050014744-A1 Benzothiazine and benzothiadiazine compounds LES LABORATROIRES SERVIER (FR) 2005-01-20 US disclosed
EP-1480986-A1 NOVEL BENZOTHIAZINE AND BENZOTHIADIAZINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Les Laboratoires Servier (FR) 2004-12-01 EP disclosed
EP-1456189-A1 BENZOTHIA(DIA)ZINE DERIVATIVES AND THEIR USE AS AMPA MODULATORS LES LABORATOIRES SERVIER (FR) 2004-09-15 EP disclosed
WO-2003053979-A1 NOVEL BENZOTHIAZINE AND BENZOTHIADIAZINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME LES LABORATOIRES SERVIER (FR) 2003-07-03 WO disclosed
WO-2003053947-A1 BENZOTHIA(DIA)ZINE DERIVATIVES AND THEIR USE AS AMPA MODULATORS LES LABORATOIRES SERVIER (FR) 2003-07-03 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-20050014744-A1 Benzothiazine and benzothiadiazine compounds HRH4, NR3C2, HRH3 CYP1A2 233/4885CYP2C9 509/4885CYP2C19 472/4885
US-20050124606-A1 Novel benzothiazine and benzothiadiazine derivatives method for preparing same and pharmaceutical compositions containing same NR4A3, NR5A2, NR4A1 CYP1A2 141/4885CYP2C9 417/4885CYP2C19 390/4885

“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.