SCHEMBL3473340

SCHEMBL3473340

CS(=O)(=O)c1cccc(-c2ccc(-c3cc(CN4CCCCCC4c4ccc(F)cc4)nn3-c3ccccc3Cl)s2)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 14/20 0.56
NR1H3 Q13133 14/20 0.56
RXRA P19793 8/20 0.56
CNR1 P21554 2/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
CFB P00751 1/20 0.35
SLC16A3 O15427 2/20 0.35
SLC16A1 P53985 2/20 0.35
MCTS1 Q9ULC4 1/20 0.35

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
SCHEMBL3472802 0.94 NR1H2 (0.57) NR1H2NR1H3RXRASLC16A3SLC16A1
SCHEMBL3471578 0.94 NR1H2 (0.55) NR1H2NR1H3RXRACFBSLC16A3
SCHEMBL3473350 0.93 NR1H2 (0.56) NR1H2NR1H3RXRACFBSLC16A3
SCHEMBL3473838 0.92 RXRA (0.54) NR1H2NR1H3RXRASLC16A3SLC16A1
SCHEMBL3472797 0.91 NR1H2 (0.55) NR1H2NR1H3RXRACFBSLC16A3
SCHEMBL3474201 0.91 NR1H2 (0.57) NR1H2NR1H3RXRACFBSLC16A3
SCHEMBL3471230 0.90 NR1H2 (0.56) NR1H2NR1H3RXRASLC16A3SLC16A1
SCHEMBL3471305 0.90 NR1H2 (0.56) NR1H2NR1H3RXRASLC16A3SLC16A1
SCHEMBL3471207 0.89 RXRA (0.54) NR1H2NR1H3RXRAKDM4EALDH1A1
SCHEMBL3472978 0.89 NR1H2 (0.54) NR1H2NR1H3RXRASLC16A3SLC16A1

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 1/4885NR1H3 2/4885RXRA 18/4885

“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.