SCHEMBL20545218

SCHEMBL20545218

COc1ccc(C(N)CC(=O)O)cc1-c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSA P10619 12/20 0.50
FFAR4 Q5NUL3 1/20 0.48
ABL1 P00519 3/20 0.46
MMP12 P39900 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.44
KCNH2 Q12809 1/20 0.43
MCHR1 Q99705 1/20 0.42

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
SCHEMBL20545217 1.00 CTSA (0.50) CTSAFFAR4ABL1MMP12PTGDR2
SCHEMBL20546274 0.88 CTSA (0.57) CTSA
SCHEMBL20546275 0.88 CTSA (0.57) CTSA
SCHEMBL30541285 0.87 FFAR4 (0.43) CTSAFFAR4ABL1KCNH2
SCHEMBL29219987 0.87 FFAR4 (0.43) CTSAFFAR4ABL1KCNH2
SCHEMBL7235672 0.83 CTSA (0.50) CTSAPTGDR2
SCHEMBL20545888 0.83 CTSA (0.50) CTSA
SCHEMBL20545890 0.83 CTSA (0.50) CTSA
SCHEMBL20545832 0.82 CTSA (0.47) CTSAFFAR4MMP12PTGDR2
SCHEMBL20545834 0.82 CTSA (0.47) CTSAFFAR4MMP12PTGDR2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3615514-B1 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS INC (US) 2023-11-22 EP disclosed
US-10875875-B2 Propionic acid derivatives and methods of use thereof AVIARA PHARMACEUTICALS, INC. (US) 2020-12-29 US disclosed
CN-110914242-A Propionic acid derivatives and methods of use thereof 阿维亚拉药品有限公司 2020-03-24 CN disclosed
EP-3615514-A2 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF Aviara Pharmaceuticals, Inc. (US) 2020-03-04 EP disclosed
US-20180312523-A1 Propionic Acid Derivatives and Methods of Use Thereof AVIARA PHARMACEUTICALS, INC. (US) 2018-11-01 US disclosed
WO-2018201167-A2 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS, INC. (US) 2018-11-01 WO 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 (2 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-20180312523-A1 Propionic Acid Derivatives and Methods of Use Thereof ITGB3, ITGA1, ITGB5 CTSA 2240/4885FFAR4 100/4885ABL1 3060/4885
US-10875875-B2 Propionic acid derivatives and methods of use thereof ITGB3, ITGA1, ITGB5 CTSA 2240/4885FFAR4 100/4885ABL1 3060/4885

“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.