SCHEMBL13312181

SCHEMBL13312181

O=C(O)CCc1ccc(COc2cccc3c2N(Cc2ccc(OCCO)cc2)CCC3)cc1F

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RXRG P48443 6/20 0.60
RXRA P19793 6/20 0.60
RXRB P28702 6/20 0.60
FFAR1 O14842 7/20 0.49
FFAR4 Q5NUL3 3/20 0.42
PTGER4 P35408 3/20 0.41
PTGER2 P43116 3/20 0.41
KDM1A O60341 1/20 0.40

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
SCHEMBL13312172 0.92 RXRB (0.66) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312230 0.90 RXRG (0.62) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312641 0.90 RXRA (0.48) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312225 0.89 RXRG (0.62) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312224 0.88 RXRG (0.61) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312164 0.86 RXRA (0.67) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312220 0.85 RXRB (0.59) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312157 0.84 RXRB (0.65) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312165 0.84 RXRA (0.65) RXRGRXRARXRBFFAR1FFAR4
SCHEMBL13312217 0.84 RXRG (0.60) RXRGRXRARXRBFFAR1FFAR4

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-20100152165-A1 CARBOXYLIC ACID DERIVATIVES ASTELLAS PHARMA INC. (JP) 2010-06-17 US disclosed
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 RXRG 541/4885RXRA 475/4885RXRB 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.