SCHEMBL5538288

SCHEMBL5538288

CC(C)OC(=O)C1CCCCN1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 1/20 0.40
PRCP P42785 1/20 0.37
SLC6A3 Q01959 4/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 1/20 0.37
DHFR P00374 1/20 0.37
DPP7 Q9UHL4 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
IDO1 P14902 1/20 0.35

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
SCHEMBL7886550 1.00 TSHR (0.40) TSHRCYP3A4CYP2D6CYP2C9PRCP
Hydrochloric Acid SCHEMBL7886551 0.98 TSHR (0.40) TSHRCYP3A4CYP2D6CYP2C9PRCP
SCHEMBL84845 0.94 PRCP (0.41) TSHRCYP3A4CYP2D6CYP2C9PRCP
SCHEMBL7782161 0.94 PRCP (0.41) TSHRCYP3A4CYP2D6CYP2C9PRCP
SCHEMBL19502428 0.94 PRCP (0.41) TSHRCYP3A4CYP2D6CYP2C9PRCP
Hydrochloric Acid SCHEMBL29401738 0.93 PRCP (0.41) CYP3A4CYP2D6PRCPDPP7CYP1A2
Hydrochloric Acid SCHEMBL16007350 0.93 PRCP (0.41) CYP3A4CYP2D6PRCPDPP7CYP1A2
Hydrochloric Acid SCHEMBL16007352 0.93 PRCP (0.41) CYP3A4CYP2D6PRCPDPP7CYP1A2
SCHEMBL31008706 0.88 TSHR (0.37) TSHRPRCPALDH1A1LMNA
Hydrochloric Acid SCHEMBL29284089 0.86 PRCP (0.36) TSHRPRCPSLC6A3SLC6A2SLC6A4

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070232559-A1 2-PROPYNYL ADENOSINE ANALOGS HAVING A2A AGONIST ACTIVITY AND COMPOSITIONS THEREOF UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2007-10-04 US claimed
EP-1108053-A1 METHOD FOR PREPARING (2R)-PIPERIDINE DERIVATIVES LONZA A.G. (CH) 2001-06-20 EP claimed
WO-2000012745-A1 METHOD FOR PREPARING (2R)-PIPERIDINE DERIVATIVES LONZA AG (CH) 2000-03-09 WO claimed
US-20230256098-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS BANK OF AMERICA, N.A. 2023-08-17 US disclosed
US-20230256098-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS BANK OF AMERICA, N.A. 2023-08-17 US disclosed
US-11679158-B2 Biodegradable lipids for the delivery of active agents ALNYLAM PHARMACEUTICALS, INC. (US) 2023-06-20 US disclosed
US-11679158-B2 Biodegradable lipids for the delivery of active agents ALNYLAM PHARMACEUTICALS, INC. (US) 2023-06-20 US disclosed
US-11633479-B2 Biodegradable lipids for the delivery of active agents ALNYLAM PHARMACEUTICALS, INC. (US) 2023-04-25 US disclosed
US-20220347302-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS ALNYLAM PHARMACEUTICALS, INC. 2022-11-03 US disclosed
US-11382979-B2 Biodegradable lipids for the delivery of active agents ALNYLAM PHARMACEUTICALS, INC. (US) 2022-07-12 US disclosed
US-20220175928-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS BANK OF AMERICA, N.A. 2022-06-09 US disclosed
US-20150306039-A1 IMPROVED NUCLEIC ACID LIPID PARTICLE FORMULATIONS BANK OF AMERICA, N.A. 2015-10-29 US disclosed
US-20150273068-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS BANK OF AMERICA, N.A. 2015-10-01 US disclosed
US-9061063-B2 Biodegradable lipids for the delivery of active agents ALNYLAM PHARMACEUTICALS, INC. (US) 2015-06-23 US disclosed
US-9012498-B2 Biodegradable lipids for the delivery of active agents ALNYLAM PHARMACEUTICALS, INC. (US) 2015-04-21 US disclosed
US-20150005363-A1 Branched Alkyl And Cycloalkyl Terminated Biodegradable Lipids For The Delivery Of Active Agents BANK OF AMERICA, N.A. 2015-01-01 US disclosed
US-20130195920-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS ALNYLAM PHARMACEUTICALS, INC. (US) 2013-08-01 US disclosed
US-20120027803-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS ALNYLAM PHARMACEUTICALS, INC. (US) 2012-02-02 US disclosed
EP-1108053-A1 METHOD FOR PREPARING (2R)-PIPERIDINE DERIVATIVES LONZA A.G. (CH) 2001-06-20 EP disclosed
WO-2000012745-A1 METHOD FOR PREPARING (2R)-PIPERIDINE DERIVATIVES LONZA AG (CH) 2000-03-09 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 (12 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-20150005363-A1 Branched Alkyl And Cycloalkyl Terminated Biodegradable Lipids For The Delivery Of Active Agents LIPA, CETP, APOB TSHR 2909/4885CYP3A4 3545/4885CYP2D6 3190/4885
US-20120027803-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS LIPA, CETP, APOB TSHR 2854/4885CYP3A4 4046/4885CYP2D6 3896/4885
US-11633479-B2 Biodegradable lipids for the delivery of active agents LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-20130195920-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-11382979-B2 Biodegradable lipids for the delivery of active agents LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-20150273068-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-20220347302-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-20070232559-A1 2-PROPYNYL ADENOSINE ANALOGS HAVING A2A AGONIST ACTIVITY AND COMPOSITIONS THEREOF ADORA2A, ADORA3, ADORA1 TSHR 203/4885CYP3A4 1117/4885CYP2D6 1452/4885
US-20220175928-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-11679158-B2 Biodegradable lipids for the delivery of active agents LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-20230256098-A1 BIODEGRADABLE LIPIDS FOR THE DELIVERY OF ACTIVE AGENTS LIPA, APOB, CETP TSHR 2733/4885CYP3A4 4393/4885CYP2D6 4283/4885
US-20150306039-A1 IMPROVED NUCLEIC ACID LIPID PARTICLE FORMULATIONS LIPA, NPC1L1, CETP TSHR 3683/4885CYP3A4 4612/4885CYP2D6 3791/4885

“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.