SCHEMBL21241272

SCHEMBL21241272

O=C(OCCc1ccccc1)C1CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 9/20 0.61
KLK7 P49862 1/20 0.60
KLK5 Q9Y337 1/20 0.60
PREP P48147 3/20 0.59
CYP3A4 P08684 1/20 0.57
MAPT P10636 1/20 0.57
CYP2C9 P11712 1/20 0.57
TSHR P16473 1/20 0.57
RAB9A P51151 1/20 0.57
CTRB1 P17538 1/20 0.56
NPSR1 Q6W5P4 1/20 0.55

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
SCHEMBL21241277 1.00 FKBP1A (0.61) FKBP1AKLK7KLK5PREPCYP3A4
SCHEMBL29692766 0.93 FKBP1A (0.69) FKBP1AKLK7KLK5PREP
SCHEMBL7326760 0.91 FKBP1A (0.66) FKBP1AKLK7KLK5PREPTSHR
SCHEMBL16272917 0.91 FKBP1A (0.66) FKBP1AKLK7KLK5PREPTSHR
SCHEMBL21241271 0.90 FKBP1A (0.70) FKBP1A
SCHEMBL21241279 0.90 FKBP1A (0.70) FKBP1A
SCHEMBL9200383 0.87 PRCP (0.61) FKBP1AKLK7KLK5PREPTSHR
SCHEMBL847403 0.86 TSHR (0.64) FKBP1AKLK7KLK5PREPTSHR
SCHEMBL14893288 0.86 TSHR (0.64) FKBP1AKLK7KLK5PREPTSHR
SCHEMBL10380778 0.86 PRCP (0.62) FKBP1AKLK7KLK5PREPTSHR

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-3746440-B1 PIPECOLIC ESTERS FOR INHIBITION OF THE PROTEASOME UNIV TEXAS (US) 2023-07-05 EP disclosed
US-11345659-B2 Pipecolic esters for inhibition of the proteasome BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-05-31 US disclosed
US-20210002220-A1 PIPECOLIC ESTERS FOR INHIBITION OF THE PROTEASOME BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2021-01-07 US disclosed
WO-2019152527-A1 PIPECOLIC ESTERS FOR INHIBITION OF THE PROTEASOME BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-08-08 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-11345659-B2 Pipecolic esters for inhibition of the proteasome PSMG3, PSME3, PSMC1 FKBP1A 1719/4885KLK7 3957/4885KLK5 4090/4885
US-20210002220-A1 PIPECOLIC ESTERS FOR INHIBITION OF THE PROTEASOME PSMG3, PSME3, PSMC1 FKBP1A 1719/4885KLK7 3957/4885KLK5 4090/4885

“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.