SCHEMBL4470498

SCHEMBL4470498

CCCCN1C(=O)C(Nc2ccc3cc(C(=O)OC(C)(C)C)oc3c2)=C(c2ccccc2)S1(O)O.CN1C(=O)C(Nc2ccc(OC(F)F)cc2)=C(c2ccccc2)S1(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 1/20 0.32
MAPT P10636 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
SCHEMBL4470496 0.96 CYP24A1 (0.33) CYP24A1MAPT
SCHEMBL3487865 0.88 SMN1; SMN2 (0.35) CYP24A1MAPT
SCHEMBL3487861 0.86 SMN1; SMN2 (0.35) CYP24A1MAPT
SCHEMBL3488389 0.82 SMN1; SMN2 (0.35) MAPT
SCHEMBL3488388 0.80 SMN1; SMN2 (0.35) MAPT
SCHEMBL3488288 0.76 CA12 (0.41) MAPT
SCHEMBL5613807 0.73 MTOR (0.36) MAPT
SCHEMBL3487236 0.72 MAPT (0.43) MAPT
SCHEMBL3486901 0.72 SMN1; SMN2 (0.38) MAPT
SCHEMBL5606506 0.72 NR1H2 (0.39) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582629-B2 Derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2009-09-01 US disclosed
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2008-10-16 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-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 CYP24A1 302/4885MAPT 1938/4885

“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.