SCHEMBL13312466

SCHEMBL13312466

COc1ccccc1C(=O)N1CCc2cccc(COc3ccc(CCC(=O)O)c(F)c3)c21

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
PARP10 Q53GL7 2/20 0.45
PARP14 Q460N5 1/20 0.45
FFAR1 O14842 13/20 0.45
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
FFAR4 Q5NUL3 3/20 0.43
PTGER4 P35408 1/20 0.43
PTGER2 P43116 1/20 0.43
PARP15 Q460N3 1/20 0.41
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
TP53 P04637 1/20 0.40
RXFP1 Q9HBX9 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
SCHEMBL13312474 0.90 FFAR1 (0.51) FFAR1RXRARXRBRXRGFFAR4
SCHEMBL13348283 0.89 ALDH1A1 (0.46) ALDH1A1PARP10PARP14PTGER4PTGER2
SCHEMBL13312467 0.89 FFAR1 (0.43) FFAR1RXRARXRBRXRGFFAR4
SCHEMBL3501563 0.88 FFAR1 (0.44) FFAR1RXRARXRBRXRGFFAR4
SCHEMBL13312492 0.87 PTGER4 (0.53) FFAR1RXRARXRBRXRGFFAR4
SCHEMBL13312462 0.87 FFAR1 (0.46) FFAR1RXRARXRBRXRGFFAR4
SCHEMBL13312469 0.87 FFAR1 (0.41) FFAR1RXRARXRBRXRGFFAR4
SCHEMBL13312477 0.86 PTGER2 (0.51) ALDH1A1FFAR1RXRARXRBRXRG
SCHEMBL13312434 0.83 FFAR1 (0.48) FFAR1RXRARXRBRXRGFFAR4
SCHEMBL13312482 0.83 FFAR1 (0.47) ALDH1A1FFAR1RXRARXRBRXRG

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 ALDH1A1 1850/4885PARP10 2338/4885PARP14 3772/4885

“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.