SCHEMBL26565274

SCHEMBL26565274

CCc1cc(C(=O)c2ccc3nc(OC)cc(-c4cccc(O[Si](C(C)C)(C(C)C)C(C)C)c4)c3c2)cnc1Cl

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 4/20 0.37
DGAT2 Q96PD7 3/20 0.35
NR1H2 P55055 6/20 0.35
NR1H3 Q13133 6/20 0.35
FOS P01100 1/20 0.34
JUN P05412 1/20 0.34
CTSA P10619 1/20 0.33
ACACA Q13085 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
IP6K1 Q92551 1/20 0.32
IP6K3 Q96PC2 1/20 0.32
IP6K2 Q9UHH9 1/20 0.32
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL26565186 0.90 LTB4R (0.38) LTB4RDGAT2MTNR1AMTNR1BTP53
SCHEMBL26565239 0.87 LTB4R (0.38) LTB4RDGAT2NR1H2NR1H3FOS
SCHEMBL26565315 0.86 LTB4R (0.36) LTB4RDGAT2FOSJUNMTNR1A
SCHEMBL26565167 0.85 LTB4R (0.39) LTB4RNR1H2NR1H3MTNR1AMTNR1B
SCHEMBL26565276 0.84 LTB4R (0.36) LTB4RDGAT2ACACATP53
SCHEMBL26565300 0.82 LTB4R (0.38) LTB4RNR1H2NR1H3MTNR1AMTNR1B
SCHEMBL26565362 0.79 PTGS2 (0.34) LTB4RDGAT2NR1H2NR1H3FOS
SCHEMBL26565540 0.79 DGAT2 (0.36) DGAT2NR1H2NR1H3TP53SMN1; SMN2
SCHEMBL26565273 0.77 RORC (0.51)
SCHEMBL26565190 0.77 LTB4R (0.36) LTB4RDGAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018011-B2 Macrocyclic compounds and compositions, and methods of preparing and using the same KURA ONCOLOGY, INC. (US) 2024-06-25 US disclosed
US-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME WUXI APPTEC (HONG KONG) LIMITED (CN) 2023-10-12 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 (2 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-12018011-B2 Macrocyclic compounds and compositions, and methods of preparing and using the same FNTA, FDPS, GGPS1 LTB4R 2287/4885DGAT2 902/4885NR1H2 22/4885
US-20230322711-A1 MACROCYCLIC COMPOUNDS AND COMPOSITIONS, AND METHODS OF PREPARING AND USING THE SAME FNTA, FDPS, GGPS1 LTB4R 2287/4885DGAT2 902/4885NR1H2 22/4885

“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.