SCHEMBL13312435

SCHEMBL13312435

O=C(O)CCc1ccc(OCc2cccc3c2N(C(=O)CCN2CCCCC2)CC3)cc1F

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
FFAR1 O14842 9/20 0.42
FFAR4 Q5NUL3 1/20 0.42
S1PR5 Q9H228 4/20 0.41
S1PR1 P21453 2/20 0.41
S1PR3 Q99500 2/20 0.41
LTA4H P09960 1/20 0.41
EGFR P00533 2/20 0.39
HRH3 Q9Y5N1 1/20 0.38
MET P08581 1/20 0.38
KCNH2 Q12809 1/20 0.38
MCHR1 Q99705 1/20 0.38

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
SCHEMBL13312504 0.87 FFAR1 (0.48) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312434 0.87 FFAR1 (0.48) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312448 0.86 FFAR1 (0.44) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312452 0.85 FFAR1 (0.45) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312429 0.84 FFAR1 (0.44) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312443 0.83 FFAR1 (0.43) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312462 0.83 FFAR1 (0.46) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312498 0.83 FFAR1 (0.51) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312507 0.82 FFAR1 (0.44) RXRARXRBRXRGFFAR1FFAR4
SCHEMBL13312441 0.81 FFAR1 (0.43) RXRARXRBRXRGFFAR1FFAR4

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 RXRA 475/4885RXRB 465/4885RXRG 541/4885

“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.