SCHEMBL3473869

SCHEMBL3473869

CC(=O)c1cc(-c2ccccc2Cl)n(-c2ccc(-c3cccc(S(C)(=O)=O)c3)cn2)n1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 7/20 0.45
RXRA P19793 6/20 0.45
NR1H3 Q13133 6/20 0.45
SCN9A Q15858 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EGLN1 Q9GZT9 1/20 0.39
KCNH2 Q12809 2/20 0.39
CHRNA7 P36544 1/20 0.39
SCD O00767 1/20 0.39

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
SCHEMBL3475403 0.90 NR1H2 (0.58) NR1H2RXRANR1H3MEN1KMT2A
SCHEMBL3474002 0.87 KMT2A (0.53) NR1H2RXRANR1H3SCN9AMEN1
SCHEMBL27716976 0.86 RXRA (0.44) NR1H2RXRANR1H3EGLN1KCNH2
SCHEMBL3471949 0.85 RXRA (0.57) NR1H2RXRANR1H3
SCHEMBL3470848 0.83 KMT2A (0.47) NR1H2RXRANR1H3SCN9AMEN1
SCHEMBL3473773 0.77 NR1H2 (0.61) NR1H2RXRANR1H3MEN1KMT2A
SCHEMBL14622602 0.75 NR1H2 (0.63) NR1H2RXRANR1H3SCN9AMEN1
SCHEMBL3471318 0.74 RXRA (0.55) NR1H2RXRANR1H3
SCHEMBL3472319 0.73 RXRA (0.57) NR1H2RXRANR1H3MEN1KMT2A
SCHEMBL3474296 0.72 NR1H2 (0.70) NR1H2RXRANR1H3KCNH2

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-8703805-B2 Modulators of LXR EXELIXIS PATENT COMPANY LLC (US) 2014-04-22 US disclosed
US-8703805-B2 Modulators of LXR EXELIXIS PATENT COMPANY LLC (US) 2014-04-22 US disclosed
US-8703805-B2 Modulators of LXR EXELIXIS PATENT COMPANY LLC (US) 2014-04-22 US disclosed
US-20100331295-A1 MODULATORS OF LXR EXELIXIS, INC. (US) 2010-12-30 US disclosed
US-20100331295-A1 MODULATORS OF LXR EXELIXIS, INC. (US) 2010-12-30 US disclosed
US-20100331295-A1 MODULATORS OF LXR EXELIXIS, INC. (US) 2010-12-30 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-20100331295-A1 MODULATORS OF LXR NR1H2, NR1H3, NR1H4 NR1H2 1/4885RXRA 18/4885NR1H3 2/4885

“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.