SCHEMBL13312448

SCHEMBL13312448

CN1CCN(CC(=O)N2CCc3cccc(COc4ccc(CCC(=O)O)c(F)c4)c32)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 14/20 0.44
FFAR4 Q5NUL3 2/20 0.44
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
DRD4 P21917 2/20 0.40
ADRA1D P25100 1/20 0.40
DRD3 P35462 1/20 0.40
DRD2 P14416 1/20 0.40
CD274 Q9NZQ7 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER2 P43116 1/20 0.39

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
SCHEMBL13348045 0.89 DRD2 (0.39) FFAR1DRD4DRD2CD274KMT2A
SCHEMBL13312434 0.88 FFAR1 (0.48) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312435 0.86 RXRA (0.44) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312452 0.85 FFAR1 (0.45) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312504 0.85 FFAR1 (0.48) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312498 0.84 FFAR1 (0.51) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312502 0.83 FFAR1 (0.49) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312462 0.83 FFAR1 (0.46) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312429 0.83 FFAR1 (0.44) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13312496 0.82 PTGER4 (0.61) FFAR1FFAR4RXRARXRBRXRG

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 FFAR1 14/4885FFAR4 15/4885RXRA 475/4885

“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.