SCHEMBL22608398

SCHEMBL22608398

CN1CCCC[C@H]1C(=O)ON(Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 12/20 0.48
CPT2 P23786 1/20 0.45
CPT1A P50416 1/20 0.45
POLB P06746 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNA5 P30532 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 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
SCHEMBL24710613 0.82 FKBP1A (0.65) FKBP1APOLBSIGMAR1MEN1KMT2A
SCHEMBL13099455 0.79 FKBP1A (0.60) FKBP1APOLBCHRNB2CHRNA5CHRNA7
SCHEMBL26291061 0.79 FKBP1A (0.60) FKBP1APOLBCHRNB2CHRNA5CHRNA7
SCHEMBL12869918 0.79 FKBP1A (0.60) FKBP1APOLBCHRNB2CHRNA5CHRNA7
SCHEMBL28066919 0.75 FKBP1A (0.51) FKBP1ACPT2CPT1APOLBSIGMAR1
SCHEMBL21271418 0.75 FKBP1A (0.51) FKBP1ACPT2CPT1APOLBSIGMAR1
SCHEMBL12733402 0.75 SIGMAR1 (0.48) FKBP1ACPT2CPT1APOLBSIGMAR1
SCHEMBL8475310 0.73 FKBP1A (0.56) FKBP1A
SCHEMBL30612528 0.73 FKBP1A (0.60) FKBP1APOLBSIGMAR1CHRNB2CHRNA5
SCHEMBL29148077 0.72 ALDH1A1 (0.52) POLBMEN1KMT2ACHRNB2CHRNA5

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 4 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
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 FKBP1A 4424/4885CPT2 1716/4885CPT1A 2379/4885
US-20210323920-A1 METHOD OF PREPARING 5R-[(BENZYLOXY) AMINO] PIPERIDINE-2S-CARBOXYLIC ACID OR A DERIVATIVE THEREOF GLUL, GRIN2D, GRIN2C FKBP1A 4424/4885CPT2 1716/4885CPT1A 2379/4885

“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.