SCHEMBL13312697

SCHEMBL13312697

CCOC(=O)CCc1ccc(COc2cccc3c2N(C(=O)COC)CCC3)cc1F

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.51
RXRG P48443 4/20 0.51
RXRB P28702 4/20 0.51
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 4/20 0.38
ATM Q13315 1/20 0.37
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
FFAR1 O14842 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL13312696 0.93 RXRA (0.53) RXRARXRGRXRBKMT2AMEN1
SCHEMBL13312693 0.90 RXRA (0.54) RXRARXRGRXRBKMT2AMEN1
SCHEMBL13312197 0.90 RXRA (0.63) RXRARXRGRXRBKMT2AMEN1
SCHEMBL13348060 0.90 RXRA (0.51) RXRARXRGRXRBKMT2AMEN1
SCHEMBL13312699 0.90 RXRA (0.50) RXRARXRGRXRBKMT2AMEN1
SCHEMBL13312698 0.89 RXRA (0.52) RXRARXRGRXRBKMT2AMEN1
SCHEMBL13312694 0.87 RXRA (0.51) RXRARXRGRXRBALDH1A1GAA
SCHEMBL13312700 0.87 RXRA (0.53) RXRARXRGRXRBALDH1A1MAPT
SCHEMBL13312639 0.87 RXRA (0.55) RXRARXRGRXRBALDH1A1GAA
SCHEMBL13312584 0.86 RXRA (0.54) RXRARXRGRXRBKMT2AMEN1

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-20100152165-A1 CARBOXYLIC ACID DERIVATIVES ASTELLAS PHARMA INC. (JP) 2010-06-17 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-20100152165-A1 CARBOXYLIC ACID DERIVATIVES GPR119, GPR65, HCAR1 RXRA 475/4885RXRG 541/4885RXRB 465/4885

“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.