SCHEMBL20546307

SCHEMBL20546307

NC(CC(=O)O)c1cccc(-c2cccnc2)c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSA P10619 8/20 0.61
KMO O15229 1/20 0.52
CTSL P07711 1/20 0.49
CTSS P25774 1/20 0.49
CTSK P43235 1/20 0.49
SUCNR1 Q9BXA5 2/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MKNK1 Q9BUB5 6/20 0.46
MKNK2 Q9HBH9 6/20 0.46
MEN1 O00255 1/20 0.46
PSIP1 O75475 1/20 0.46
AXL P30530 1/20 0.46
PIM1 P11309 1/20 0.44
PIM2 Q9P1W9 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
SCHEMBL20546305 1.00 CTSA (0.61) CTSAKMOCTSLCTSSCTSK
SCHEMBL7237272 0.86 MKNK1 (0.54) CTSAKMOSUCNR1MKNK1MKNK2
SCHEMBL20546132 0.84 KMT2A (0.58) CTSAKMT2ASMN1; SMN2
SCHEMBL20546130 0.84 KMT2A (0.58) CTSAKMT2ASMN1; SMN2
SCHEMBL30829068 0.84 TBXAS1 (0.50) CTSASMN1; SMN2
SCHEMBL157096 0.84 TBXAS1 (0.50) CTSASMN1; SMN2
SCHEMBL157097 0.84 TBXAS1 (0.50) CTSASMN1; SMN2
SCHEMBL5720941 0.84 TBXAS1 (0.50) CTSASMN1; SMN2
SCHEMBL20546126 0.83 PIM2 (0.50) CTSASUCNR1KMT2ASMN1; SMN2PIM1
SCHEMBL20546125 0.83 PIM2 (0.50) CTSASUCNR1KMT2ASMN1; SMN2PIM1

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 2240/4885KMO 3946/4885CTSL 2956/4885
US-10875875-B2 Propionic acid derivatives and methods of use thereof ITGB3, ITGA1, ITGB5 CTSA 2240/4885KMO 3946/4885CTSL 2956/4885

“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.