SCHEMBL4094643

SCHEMBL4094643

CS(=O)(=O)c1cc(CCC(=O)O)nc(-c2nc(=O)c3ccc(Cl)cc3s2)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.42
PPARG P37231 4/20 0.35
PPARD Q03181 4/20 0.35
PPARA Q07869 3/20 0.35
MCL1 Q07820 2/20 0.34
BCKDK O14874 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
PTGDR2 Q9Y5Y4 4/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
GPR17 Q13304 1/20 0.32

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
Tromethamine SCHEMBL4093011 0.94 HDAC6 (0.37) HDAC6PPARGPPARDPPARAMCL1
SCHEMBL4093006 0.90 MEN1 (0.33) HDAC6PPARGPPARDPPARAMCL1
Potassium Ion SCHEMBL4088703 0.90 MEN1 (0.33) HDAC6PPARGPPARDPPARAMCL1
SCHEMBL4082600 0.90 EGFR (0.38) PPARAMCL1RXFP1CASP3SENP8
SCHEMBL4089067 0.89 NPC1 (0.34) HDAC6MCL1MEN1KMT2ARXRA
SCHEMBL4622103 0.89 LMNA (0.35) PPARACASP3SENP8SENP7SENP6
SCHEMBL4093194 0.88 PTGDR2 (0.36) BCKDKPTGDR2RXRARXRBRXRG
SCHEMBL4085450 0.88 KDM4E (0.36) MCL1CASP3SENP8SENP7SENP6
SCHEMBL4618747 0.88 LMNA (0.34) PPARACASP3SENP8SENP7SENP6
SCHEMBL4619193 0.88 LMNA (0.34) PPARACASP3SENP8SENP7SENP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090029975-A1 1,3-BENZOTHIAZINONE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-29 US claimed
US-20090029975-A1 1,3-BENZOTHIAZINONE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-29 US disclosed
US-20090029975-A1 1,3-BENZOTHIAZINONE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-29 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-20090029975-A1 1,3-BENZOTHIAZINONE DERIVATIVE AND USE THEREOF MIF, CCL2, MSR1 HDAC6 828/4885PPARG 1724/4885PPARD 2241/4885

“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.