SCHEMBL20857397

SCHEMBL20857397

CCOC(=O)C[C@@H](c1cccc(Cc2ccccc2)c1)N(Cc1ccccc1)[C@H](C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.44
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
F2 P00734 3/20 0.39
TSHR P16473 1/20 0.39
LTA4H P09960 10/20 0.38
TP53 P04637 1/20 0.38
PRSS1 P07477 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 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
SCHEMBL31109299 0.96 F10 (0.41) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL31109317 0.95 F10 (0.42) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL29113404 0.92 F10 (0.43) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL31109312 0.92 F10 (0.43) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL29113444 0.92 TACR1 (0.39) F10F2MEN1KMT2A
SCHEMBL31109220 0.91 F2 (0.43) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL13143762 0.89 F10 (0.44) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL22837948 0.89 F10 (0.44) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL13120953 0.89 F10 (0.44) F10ALDH1A1LMNAPOLBHSD17B10
SCHEMBL29113408 0.89 ALDH1A1 (0.45) F10ALDH1A1LMNAPOLBHSD17B10

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-3615515-B1 PROPIONIC ACID DERIVATIVES AND METHODS OF USE THEREOF AVIARA PHARMACEUTICALS INC (US) 2024-09-25 EP disclosed
US-20190225602-A1 Propionic Acid Derivatives and Methods of Use Thereof AVIARA PHARMACEUTICALS, INC. (US) 2019-07-25 US disclosed
US-10246451-B2 Propionic acid derivatives and methods of use thereof AVIARA PHARMACEUTICALS, INC. (US) 2019-04-02 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-10246451-B2 Propionic acid derivatives and methods of use thereof ITGA4, ITGB3, ITGB5 F10 639/4885ALDH1A1 232/4885LMNA 2963/4885
US-20190225602-A1 Propionic Acid Derivatives and Methods of Use Thereof ITGA4, ITGB3, ITGB4 F10 825/4885ALDH1A1 141/4885LMNA 2557/4885

“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.