SCHEMBL4905484

SCHEMBL4905484

CC(C)c1cnc(S(C)(=O)=O)c(-c2coc(-c3cc(C(F)(F)F)c(C#N)c(=O)n3Cc3ccc(F)cc3F)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.52
NR1H2 P55055 4/20 0.52
NR1H3 Q13133 4/20 0.52
GNRHR P30968 1/20 0.31
CNR2 P34972 2/20 0.31
CNR1 P21554 1/20 0.31

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
SCHEMBL2389190 0.90 RXRA (0.53) RXRANR1H2NR1H3
SCHEMBL2389061 0.87 RXRA (0.54) RXRANR1H2NR1H3
SCHEMBL2386307 0.85 RXRA (0.59) RXRANR1H2NR1H3
SCHEMBL2387739 0.84 RXRA (0.51) RXRANR1H2NR1H3
SCHEMBL2389548 0.84 RXRA (0.56) RXRANR1H2NR1H3
SCHEMBL2387164 0.83 RXRA (0.51) RXRANR1H2NR1H3GNRHR
SCHEMBL2389388 0.82 RXRA (0.63) RXRANR1H2NR1H3
SCHEMBL2389321 0.82 RXRA (0.51) RXRANR1H2NR1H3
SCHEMBL2388571 0.81 RXRA (0.53) RXRANR1H2NR1H3
SCHEMBL2389137 0.81 RXRA (0.47) RXRANR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 US claimed

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-20080119488-A1 Modulators Of Nuclear Receptors NR1H2, NR0B1, NR1H3 RXRA 20/4885NR1H2 1/4885NR1H3 3/4885

“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.