SCHEMBL20545768

SCHEMBL20545768

Cc1cccc(C)c1-c1ccc(C(N)CC(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 11/20 0.47
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
CASP1 P29466 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TPH1 P17752 1/20 0.41
SCN4A P35499 4/20 0.41
DHODH Q02127 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
SCHEMBL20545766 1.00 FFAR1 (0.47) FFAR1PPARGPPARACASP1KMT2A
SCHEMBL20545289 0.84 SLC1A3 (0.54) FFAR1PPARGPPARAKMT2ASMN1; SMN2
SCHEMBL20545291 0.84 SLC1A3 (0.54) FFAR1PPARGPPARAKMT2ASMN1; SMN2
SCHEMBL20545501 0.84 FFAR1 (0.51) FFAR1KMT2ASMN1; SMN2
SCHEMBL20545503 0.84 FFAR1 (0.51) FFAR1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL28510787 0.83 FFAR1 (0.50) FFAR1KMT2ASMN1; SMN2
SCHEMBL20546380 0.82 FFAR1 (0.44) FFAR1CASP1KMT2ASMN1; SMN2
SCHEMBL20546384 0.82 FFAR1 (0.44) FFAR1CASP1KMT2ASMN1; SMN2
SCHEMBL7227091 0.82 ITGB1 (0.49) FFAR1KMT2ASMN1; SMN2
SCHEMBL28375240 0.82 ALDH1A1 (0.43) FFAR1PPARGPPARASCN4A

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 5 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
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 FFAR1 37/4885PPARG 582/4885PPARA 489/4885
US-10875875-B2 Propionic acid derivatives and methods of use thereof ITGB3, ITGA1, ITGB5 FFAR1 37/4885PPARG 582/4885PPARA 489/4885

“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.