SCHEMBL22608474

SCHEMBL22608474

CCOC(=O)CC[C@H](C(=O)OCC)N(CC(=O)OCC)Cc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.49
MAPT P10636 2/20 0.47
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ALOX5 P09917 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 1/20 0.41
LTA4H P09960 3/20 0.40
PIN1 Q13526 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
EPOR P19235 1/20 0.39

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
SCHEMBL22608475 1.00 TP53 (0.49) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL22608472 1.00 TP53 (0.49) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL28406626 0.94 TP53 (0.47) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL28400999 0.94 TP53 (0.47) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL28401001 0.94 TP53 (0.47) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL19617430 0.86 TP53 (0.50) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL22608280 0.86 ALDH1A1 (0.45) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL22608278 0.86 ALDH1A1 (0.45) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL22608277 0.86 ALDH1A1 (0.45) TP53MAPTALDH1A1L3MBTL1LMNA
SCHEMBL7950550 0.81 CA1 (0.41) TP53ALDH1A1L3MBTL1LMNAALOX5

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-3733648-B1 METHOD FOR PREPARING 5R-BENZYLOXYAMINOPIPERIDIN-2S-CARBOXYLIC ACID OR DERIVATIVE THEREOF XINFA PHARMACEUTICAL CO LTD (CN) 2022-06-08 EP disclosed
US-20210323920-A1 METHOD OF PREPARING 5R-[(BENZYLOXY) AMINO] PIPERIDINE-2S-CARBOXYLIC ACID OR A DERIVATIVE THEREOF XINFA PHARMACEUTICAL CO., LTD (CN) 2021-10-21 US disclosed
US-11142499-B1 Method of preparing 5R-[(benzyloxy) amino] piperidine-2S-carboxylic acid or a derivative thereof XINFA PHARMACEUTICAL CO., LTD (CN) 2021-10-12 US disclosed
CN-109970625-B Preparation method of 5R-benzyloxyaminopiperidine-2S-formic acid or derivative thereof 新发药业有限公司 2021-02-26 CN disclosed
EP-3733648-A1 METHOD FOR PREPARING 5R-BENZYLOXYAMINOPIPERIDIN-2S-CARBOXYLIC ACID OR DERIVATIVE THEREOF Xinfa Pharmaceutical Co., Ltd (CN) 2020-11-04 EP 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-11142499-B1 Method of preparing 5R-[(benzyloxy) amino] piperidine-2S-carboxylic acid or a derivative thereof GLUL, GRIN2D, GRIN2C TP53 3931/4885MAPT 3757/4885ALDH1A1 221/4885
US-20210323920-A1 METHOD OF PREPARING 5R-[(BENZYLOXY) AMINO] PIPERIDINE-2S-CARBOXYLIC ACID OR A DERIVATIVE THEREOF GLUL, GRIN2D, GRIN2C TP53 3931/4885MAPT 3757/4885ALDH1A1 221/4885

“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.