SCHEMBL3472748

SCHEMBL3472748

NC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccc(-c3cc(C(F)(F)F)nn3-c3ccccc3Cl)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
RXRA P19793 3/20 0.51
NR1H2 P55055 3/20 0.51
NR1H3 Q13133 3/20 0.51
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
TP53 P04637 1/20 0.50
PTGS2 P35354 4/20 0.46
PTGS1 P23219 1/20 0.46
EPHX2 P34913 1/20 0.46
ORAI1 Q96D31 1/20 0.46
THRB P10828 2/20 0.45
PDPK1 O15530 1/20 0.45
F10 P00742 2/20 0.43
F2 P00734 1/20 0.43
MAPK9 P45984 1/20 0.43

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
SCHEMBL3473293 0.92 RXRA (0.54) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3472857 0.89 MAPT (0.57) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3473704 0.88 RXRA (0.55) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3471277 0.86 MAPT (0.57) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3471938 0.86 ORAI1 (0.60) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3471324 0.86 MAPT (0.59) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3474142 0.86 MAPT (0.59) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3472102 0.86 MAPT (0.61) MAPTRXRANR1H2NR1H3POLB
SCHEMBL3472428 0.85 MEN1 (0.56) MAPTPOLBPTGS1
SCHEMBL3473738 0.85 PTGS2 (0.57) MAPTRXRANR1H2NR1H3POLB

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 MAPT 4737/4885RXRA 18/4885NR1H2 1/4885

“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.