SCHEMBL2960071

SCHEMBL2960071

COCCNC(=O)c1cccc(-c2nc(=O)c3ccccc3s2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 10/20 0.49
ALDH1A1 P00352 7/20 0.49
KDM4E B2RXH2 6/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
RAB9A P51151 4/20 0.49
NPC1 O15118 2/20 0.49
MAPK1 P28482 2/20 0.49
HTT P42858 2/20 0.49
MIF P14174 1/20 0.48
GABRA1 P14867 1/20 0.48
TP53 P04637 1/20 0.44
LMNA P02545 3/20 0.43
KAT2A Q92830 1/20 0.43
KAT2B Q92831 1/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
MEN1 O00255 1/20 0.41
APEX1 P27695 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CASP3 P42574 1/20 0.40

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
SCHEMBL2949286 0.89 RAB9A (0.50) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL2964085 0.89 MIF (0.52) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL2962166 0.84 NPSR1 (0.52) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL2949803 0.83 HPGD (0.57) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL4067890 0.83 NPSR1 (0.48) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL13217267 0.83 NPSR1 (0.48) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL13199761 0.82 HPGD (0.48) HPGDKDM4EMAPK1MIFGABRA1
Hydrochloric Acid SCHEMBL2956299 0.82 NPSR1 (0.48) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL2960271 0.81 MIF (0.49) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A
SCHEMBL2963298 0.77 CYP1A2 (0.54) HPGDALDH1A1KDM4ESMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767665-B2 3-[6-(4-oxo-4H-1,3-benzothiazin-2-yl)-2-pyridyl]propionic acid, having an excellent apoptosis inhibitory and Macrophage migration inhibitory factor (MIF) binding effects, used for preventing and/or treating cancers, AIDS, cardiovascular, neurodegeneartive, bone, kidney and liver disoders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-03 US disclosed
US-7767665-B2 3-[6-(4-oxo-4H-1,3-benzothiazin-2-yl)-2-pyridyl]propionic acid, having an excellent apoptosis inhibitory and Macrophage migration inhibitory factor (MIF) binding effects, used for preventing and/or treating cancers, AIDS, cardiovascular, neurodegeneartive, bone, kidney and liver disoders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-03 US disclosed
US-20090082343-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-03-26 US disclosed
US-20090082343-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-03-26 US disclosed
US-7399759-B2 1, 3-benzothiazinone derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-15 US disclosed
US-7399759-B2 1, 3-benzothiazinone derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-15 US disclosed
US-20050032786-A1 1, 3-benzothiazinone derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-02-10 US disclosed
EP-1424336-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-06-02 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-20090082343-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF MIF, MORF4L1, FOXM1 HPGD 1550/4885ALDH1A1 273/4885KDM4E 3627/4885
US-20050032786-A1 1, 3-benzothiazinone derivatives and use thereof MIF, MORF4L1, FOXM1 HPGD 1550/4885ALDH1A1 273/4885KDM4E 3627/4885

“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.