SCHEMBL669136

SCHEMBL669136

COC(=O)CC1CC(c2ccc(OC)cc2)=NO1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 13/20 1.00
▸ HDAC6 Q9UBN7 1/20 0.79
▸ NPC1 O15118 1/20 0.61
▸ RAB9A P51151 1/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61

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
SCHEMBL15304593 0.90 MIF (0.81) MIFHDAC6NPC1RAB9ASMN1; SMN2
SCHEMBL668287 0.88 MIF (1.00) MIFHDAC6
SCHEMBL667518 0.88 MIF (1.00) MIFHDAC6NPC1RAB9ASMN1; SMN2
SCHEMBL667764 0.88 MIF (1.00) MIFHDAC6
SCHEMBL455228 0.88 MIF (1.00) MIFHDAC6
SCHEMBL15082890 0.87 MIF (0.79) MIFHDAC6NPC1RAB9A
SCHEMBL14642447 0.86 MIF (0.78) MIFHDAC6
SCHEMBL12517503 0.85 MIF (0.75) MIFHDAC6
SCHEMBL7372374 0.83 MIF (0.72) MIFHDAC6
SCHEMBL7373045 0.83 MIF (0.72) MIFHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552040-B2 Isoxazoline compounds having MIF antagonist activity CPSI STOCKHOLDER TRUST (US) 2013-10-08 — — US disclosed
US-8552040-B2 Isoxazoline compounds having MIF antagonist activity CPSI STOCKHOLDER TRUST (US) 2013-10-08 — — US disclosed
EP-1411930-B1 ISOXAZOLINE COMPOUNDS HAVING MIF ANTAGONIST ACTIVITY CYTOKINE PHARMASCIENCES INC (US) 2013-01-16 — — EP disclosed
EP-1411930-B1 ISOXAZOLINE COMPOUNDS HAVING MIF ANTAGONIST ACTIVITY CYTOKINE PHARMASCIENCES INC (US) 2013-01-16 — — EP disclosed
US-20120046325-A1 Isoxazoline Compounds Having MIF Antagonist Activity CYTOKINE PHARMASCIENCES, INC. (US) 2012-02-23 — — US disclosed
US-20120046325-A1 Isoxazoline Compounds Having MIF Antagonist Activity CYTOKINE PHARMASCIENCES, INC. (US) 2012-02-23 — — US disclosed
US-7928130-B2 Isoxazoline compounds having MIF antagonist activity CYTOKINE PHARMASCIENCES, INC. (US) 2011-04-19 — — US disclosed
US-7928130-B2 Isoxazoline compounds having MIF antagonist activity CYTOKINE PHARMASCIENCES, INC. (US) 2011-04-19 — — US disclosed
US-7662843-B2 Isoxazoline compounds having MIF antagonist activity CYTOKINE PHARMASCIENCES, INC. (US) 2010-02-16 — — US disclosed
US-7662843-B2 Isoxazoline compounds having MIF antagonist activity CYTOKINE PHARMASCIENCES, INC. (US) 2010-02-16 — — US disclosed
US-20100016391-A1 Isoxazoline Compounds Having MIF Antagonist Activity CYTOKINE PHARMASCIENCES, INC. (US) 2010-01-21 — — US disclosed
US-20100016391-A1 Isoxazoline Compounds Having MIF Antagonist Activity CYTOKINE PHARMASCIENCES, INC. (US) 2010-01-21 — — US disclosed
US-7491740-B2 Isoxazoline compounds having MIF antagonist activity CYTOKINE PHARMASCIENCES, INC. (US) 2009-02-17 — — US disclosed
US-7491740-B2 Isoxazoline compounds having MIF antagonist activity CYTOKINE PHARMASCIENCES, INC. (US) 2009-02-17 — — US disclosed
US-20040204464-A1 Isoxazoline compounds having MIF antagonist activity CPSI STOCKHOLDER TRUST 2004-10-14 — — US disclosed
US-20030008908-A1 Isoxazoline compounds having MIF antagonist activity CPSI STOCKHOLDER TRUST 2003-01-09 — — 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 (4 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-20030008908-A1 Isoxazoline compounds having MIF antagonist activity MIF, PGF, HLA-DRB1 MIF 1/4885HDAC6 1626/4885NPC1 4851/4885
US-20120046325-A1 Isoxazoline Compounds Having MIF Antagonist Activity MIF, PGF, HMGB2 MIF 1/4885HDAC6 1645/4885NPC1 4857/4885
US-20040204464-A1 Isoxazoline compounds having MIF antagonist activity MIF, PGF, HLA-DRB1 MIF 1/4885HDAC6 1626/4885NPC1 4851/4885
US-20100016391-A1 Isoxazoline Compounds Having MIF Antagonist Activity MIF, PGF, HMGB2 MIF 1/4885HDAC6 1645/4885NPC1 4857/4885

“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.

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