SCHEMBL20546385

SCHEMBL20546385

NC(CC(=O)O)c1cccc(-c2ccccc2)c1F

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSA P10619 7/20 0.41
FFAR1 O14842 1/20 0.39
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.38
BCAT2 O15382 1/20 0.38
CASP1 P29466 1/20 0.37

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
SCHEMBL20546383 1.00 CTSA (0.41) CTSAFFAR1KMT2ASMN1; SMN2MEN1
SCHEMBL7714320 0.85 KMT2A (0.43) CTSAFFAR1KMT2ASMN1; SMN2BCAT2
SCHEMBL30541236 0.84 PTPN1 (0.43) SMN1; SMN2
SCHEMBL28373905 0.84 PTPN1 (0.43) SMN1; SMN2
SCHEMBL20545887 0.83 CD274 (0.47) CTSAKMT2ASMN1; SMN2BCAT2
SCHEMBL20545885 0.83 CD274 (0.47) CTSAKMT2ASMN1; SMN2BCAT2
SCHEMBL29115978 0.81 CES2 (0.46) CTSAKMT2ASMN1; SMN2MEN1
SCHEMBL29115980 0.81 CES2 (0.46) CTSAKMT2ASMN1; SMN2MEN1
SCHEMBL12494460 0.78 CFD (0.54) CTSAKMT2AMEN1
SCHEMBL2457680 0.77 EEF2K (0.47) CTSAKMT2ASMN1; SMN2MEN1

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 CTSA 2240/4885FFAR1 37/4885KMT2A 4455/4885
US-10875875-B2 Propionic acid derivatives and methods of use thereof ITGB3, ITGA1, ITGB5 CTSA 2240/4885FFAR1 37/4885KMT2A 4455/4885

“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.