SCHEMBL20545894

SCHEMBL20545894

N[C@@H](CC(=O)O)c1cccc(-c2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSA P10619 7/20 0.52
F9 P00740 2/20 0.50
MMP12 P39900 4/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MME P08473 1/20 0.48
FFAR1 O14842 1/20 0.47
SUCNR1 Q9BXA5 1/20 0.47
MMP13 P45452 1/20 0.46
SLC13A5 Q86YT5 1/20 0.45
EPHX1 P07099 1/20 0.44

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
SCHEMBL20545896 1.00 CTSA (0.52) CTSAF9MMP12KMT2ASMN1; SMN2
SCHEMBL20546028 0.91 CTSA (0.61) CTSAKMT2ASMN1; SMN2MMEFFAR1
SCHEMBL20546029 0.91 CTSA (0.61) CTSAKMT2ASMN1; SMN2MMEFFAR1
SCHEMBL30412148 0.85 KMT2A (0.61) CTSAMMP12KMT2ASMN1; SMN2MME
SCHEMBL20764626 0.85 KMT2A (0.61) CTSAMMP12KMT2ASMN1; SMN2MME
SCHEMBL30671307 0.85 POLB (0.46) CTSAF9MMP12MMP13
SCHEMBL28368517 0.85 POLB (0.46) CTSAF9MMP12MMP13
SCHEMBL20545877 0.84 CTSA (0.47) CTSAMMP12KMT2ASMN1; SMN2MME
SCHEMBL20545879 0.84 CTSA (0.47) CTSAMMP12KMT2ASMN1; SMN2MME
SCHEMBL20546265 0.83 FFAR1 (0.54) CTSAKMT2ASMN1; SMN2FFAR1

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 3 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
US-20180312523-A1 Propionic Acid Derivatives and Methods of Use Thereof AVIARA PHARMACEUTICALS, INC. (US) 2018-11-01 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 (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 2240/4885F9 685/4885MMP12 2983/4885
US-10875875-B2 Propionic acid derivatives and methods of use thereof ITGB3, ITGA1, ITGB5 CTSA 2240/4885F9 685/4885MMP12 2983/4885

“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.