SCHEMBL13199826

SCHEMBL13199826

CC(C)(C)OC(=O)CCc1cccc(-c2nc(=O)c3ccc(F)cc3s2)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MIF P14174 2/20 0.33
GABRA1 P14867 1/20 0.33
CCNT1 O60563 1/20 0.33
KCNH2 Q12809 1/20 0.32
STING1 Q86WV6 1/20 0.32
CNR1 P21554 5/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
DGAT2 Q96PD7 1/20 0.31
P2RY12 Q9H244 1/20 0.31
SENP1 Q9P0U3 1/20 0.31
DYRK1A Q13627 2/20 0.30
PDPK1 O15530 1/20 0.30

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
SCHEMBL2952896 0.90 MIF (0.34) MIFGABRA1STING1P2RY12
SCHEMBL2960615 0.89 DYRK1A (0.34) MIFGABRA1P2RY12DYRK1A
SCHEMBL3146975 0.89 MIF (0.33) MIFGABRA1STING1P2RY12DYRK1A
SCHEMBL2955664 0.88 DYRK1A (0.37) MIFGABRA1STING1DYRK1A
SCHEMBL13199721 0.87 MIF (0.46) MIFGABRA1KCNH2STING1P2RY12
SCHEMBL4088762 0.85 PIK3CD (0.34) STING1
SCHEMBL2952932 0.85 MIF (0.38) MIFGABRA1SENP1
SCHEMBL13199828 0.82 GABRA1 (0.35) MIFGABRA1CCNT1STING1DGAT2
SCHEMBL2964093 0.79 MIF (0.42) MIFGABRA1KCNH2STING1P2RY12
SCHEMBL13200283 0.79 MIF (0.42) MIFGABRA1P2RY12

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-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

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-20090082343-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF MIF, MORF4L1, FOXM1 MIF 1/4885GABRA1 3323/4885CCNT1 506/4885

“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.