SCHEMBL1936718

SCHEMBL1936718

COC1CCCN(C(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.43
DPP7 Q9UHL4 1/20 0.43
VNN1 O95497 1/20 0.40
RAB9A P51151 4/20 0.37
NPC1 O15118 3/20 0.37
GRM5 P41594 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
SPR P35270 1/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 1/20 0.35
HIF1A Q16665 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE7B Q9NP56 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL4467851 1.00 DPP4 (0.43) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL4472161 1.00 DPP4 (0.43) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL331691 0.88 NPC1 (0.39) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL331813 0.88 NPC1 (0.39) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL1936247 0.88 NPC1 (0.39) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL14548914 0.85 DPP4 (0.43) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL23581420 0.83 DPP4 (0.45) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL426886 0.83 DPP4 (0.42) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL791935 0.83 PDE4B (0.43) DPP4DPP7VNN1RAB9ANPC1
SCHEMBL5959875 0.82 TAAR1 (0.35) DPP4DPP7TAAR1ALDH1A1LMNA

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023227125-A1 NEW FUSED-HETEROCYCLIC COMPOUND AS CDK INHIBITOR AND USE THEREOF 杭州德睿智药科技有限公司 2023-11-30 WO disclosed
WO-2022258038-A1 PYRROLE ACYL PIPERYLHYDRAZINE COMPOUND AND USE THEREOF 中国医学科学院药物研究所 2022-12-15 WO disclosed
CN-111247136-A Pyrimidinyl-pyridyloxy-naphthyl compounds and methods of treating diseases and disorders associated with IRE1 吉宁特有限公司 2020-06-05 CN disclosed
US-20140073627-A1 BRADYKININ B1 ANTAGONISTS EVOTEC AG (DE) 2014-03-13 US disclosed
US-8623859-B2 Bradykinin B1 antagonists EVOTEC AG (DE) 2014-01-07 US disclosed
US-20110201589-A1 NEW BRADYKININ B1 ANTAGONISTS EVOTEC AG (DE) 2011-08-18 US disclosed
EP-2331518-A1 NEW BRADYKININ B1 ANTAGONISTS Evotec AG (DE) 2011-06-15 EP disclosed
CN-102066367-A Thiazolylpiperidine Derivatives MERCK PATENT GMBH 2011-05-18 CN disclosed
EP-2205559-A1 RENIN INHIBITORS Cadila Healthcare Limited (IN) 2010-07-14 EP disclosed
EP-2158199-A1 PIPERIDINE COMPOUNDS AND USES THEREOF AstraZeneca AB (SE) 2010-03-03 EP disclosed
WO-2010020556-A1 NEW BRADYKININ B1 ANTAGONISTS EVOTEC NEUROSCIENCES GMBH (DE) 2010-02-25 WO disclosed
WO-2009087649-A1 RENIN INHIBITORS CADILA HEALTHCARE LIMITED (IN) 2009-07-16 WO disclosed
WO-2008152418-A1 PIPERIDINE COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2008-12-18 WO disclosed
EP-1853586-A1 ANTIBACTERIAL PIPERIDINE DERIVATIVES AstraZeneca AB (SE) 2007-11-14 EP disclosed
WO-2006087543-A1 ANTIBACTERIAL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2006-08-24 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-20140073627-A1 BRADYKININ B1 ANTAGONISTS BDKRB1, BDKRB2, BRS3 DPP4 2463/4885DPP7 3286/4885VNN1 1745/4885
US-20110201589-A1 NEW BRADYKININ B1 ANTAGONISTS BDKRB1, BDKRB2, BRS3 DPP4 2260/4885DPP7 3095/4885VNN1 1480/4885

“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.