SCHEMBL2263649

SCHEMBL2263649

CCOC(=O)c1ccc(Oc2ccc(-c3cc(C(F)(F)F)c(C#N)c(=O)n3Cc3ccc(C)cc3C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.56
NR1H2 P55055 3/20 0.56
NR1H3 Q13133 3/20 0.56
RXFP1 Q9HBX9 5/20 0.42
MAPT P10636 4/20 0.42
THRB P10828 2/20 0.40
TP53 P04637 1/20 0.40
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SCN9A Q15858 2/20 0.35
NT5E P21589 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
AR P10275 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
ATM Q13315 1/20 0.35
CMA1 P23946 1/20 0.34

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
SCHEMBL2265430 0.94 RXRA (0.57) RXRANR1H2NR1H3RXFP1MAPT
SCHEMBL2387622 0.91 RXRA (0.61) RXRANR1H2NR1H3RXFP1MAPT
SCHEMBL12390143 0.90 RXRA (0.42) RXRANR1H2NR1H3MAPTMEN1
SCHEMBL2266726 0.90 NR1H2 (0.65) RXRANR1H2NR1H3RXFP1MAPT
SCHEMBL2264159 0.89 NR1H2 (0.60) RXRANR1H2NR1H3RXFP1MAPT
SCHEMBL2262223 0.88 RXRA (0.50) RXRANR1H2NR1H3RXFP1MAPT
SCHEMBL2264983 0.88 NR1H2 (0.61) RXRANR1H2NR1H3RXFP1MAPT
SCHEMBL2262290 0.87 NR1H2 (0.62) RXRANR1H2NR1H3MAPTKMT2A
SCHEMBL2262577 0.87 NR1H2 (0.62) RXRANR1H2NR1H3RXFP1MAPT
SCHEMBL14184088 0.87 RXRA (0.53) RXRANR1H2NR1H3RXFP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7998986-B2 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS PATENT COMPANY LLC (US) 2011-08-16 US disclosed
EP-1465869-A4 MODULATORS OF LXR X CEPTOR THERAPEUTICS INC (US) 2005-12-28 EP disclosed
EP-1465869-A1 MODULATORS OF LXR X-Ceptor Therapeutics, Inc. (US) 2004-10-13 EP disclosed
US-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors EXELIXIS, INC. 2003-09-25 US disclosed
WO-2003059884-A1 MODULATORS OF LXR X-CEPTOR THERAPEUTICS, INC. (US) 2003-07-24 WO 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-20030181420-A1 Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors NR1H2, NR1H3, NCOA1 RXRA 16/4885NR1H2 1/4885NR1H3 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.