SCHEMBL20546387

SCHEMBL20546387

CCOC(=O)CC(NC(c1ccccc1)(c1ccccc1)c1ccccc1)c1cccc(-c2cccc(C(C)=O)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
F10 P00742 2/20 0.40
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HDAC2 Q92769 1/20 0.36
CTSA P10619 2/20 0.36
TP53 P04637 1/20 0.36
POLB P06746 1/20 0.36
F2 P00734 1/20 0.36
PRSS1 P07477 1/20 0.36

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
SCHEMBL20546321 0.93 MAPT (0.40) LMNAF10MEN1MAPTKMT2A
SCHEMBL20546057 0.83 F10 (0.39) LMNAF10MAPTPOLBF2
SCHEMBL20545644 0.82 NPSR1 (0.42) LMNAF10MAPTCTSA
SCHEMBL20546217 0.79 MAPT (0.40) MEN1MAPTKMT2AL3MBTL1CTSA
SCHEMBL20546631 0.78 LMNA (0.37) LMNAF10MAPT
SCHEMBL20546553 0.76 FAAH (0.40) LMNAMEN1MAPTKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL20545873 0.76 F10 (0.43) LMNAPKMF10F2PRSS1
Hydrochloric Acid SCHEMBL30541324 0.76 F10 (0.43) LMNAPKMF10F2PRSS1
SCHEMBL20545717 0.75 ALDH1A1 (0.38) LMNAPKMMEN1KMT2ATDP1
SCHEMBL20545886 0.74 PTGDR2 (0.41) MAPTKMT2AL3MBTL1CTSATP53

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 7 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
CN-110914242-B Propionic acid derivatives and methods of use thereof 阿维亚拉药品有限公司 2023-07-25 CN 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 LMNA 2435/4885PKM 1098/4885F10 602/4885
US-10875875-B2 Propionic acid derivatives and methods of use thereof ITGB3, ITGA1, ITGB5 LMNA 2435/4885PKM 1098/4885F10 602/4885

“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.