SCHEMBL720328

SCHEMBL720328

N[C@H]1CCCCN(OC(=O)C2CCCN2)C1=O

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.34
DPP8 Q6V1X1 3/20 0.34
DPP9 Q86TI2 2/20 0.34
FAP Q12884 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
NOS2 P35228 2/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAPT P10636 1/20 0.33
APEX1 P27695 1/20 0.33
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
ELANE P08246 1/20 0.31
DRD2 P14416 2/20 0.31
ANPEP P15144 1/20 0.31
PARP1 P09874 1/20 0.30
HTR2C P28335 1/20 0.30

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
SCHEMBL1114767 1.00 DPP4 (0.34) DPP4DPP8DPP9FAPDPP7
SCHEMBL5699875 0.84 DPP4 (0.34) DPP4DPP8DPP9FAPDPP7
SCHEMBL195277 0.78 DPP4 (0.35) DPP4DPP8DPP9FAPDPP7
SCHEMBL9803421 0.77 DPP4 (0.37) DPP4DPP8DPP9FAPDPP7
SCHEMBL444869 0.73 DPP4 (0.42) DPP4DPP8DPP9FAPDPP7
SCHEMBL4963191 0.71 DPP4 (0.41) DPP4DPP8DPP9FAPDPP7
SCHEMBL9194164 0.69 DPP4 (0.36) DPP4DPP8DPP9FAPDPP7
SCHEMBL5689235 0.69 DPP4 (0.36) DPP4DPP8DPP9FAPDPP7
SCHEMBL28407251 0.66 DPP4 (0.36) DPP4DPP8DPP9FAPDPP7
SCHEMBL14668189 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8497261-B2 3-aminocaprolactam compounds for treating inflammatory disorders CAMBRIDGE ENTERPRISE LIMITED (GB) 2013-07-30 US disclosed
EP-1691814-B9 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTPR LTD (GB) 2013-02-20 EP disclosed
EP-1896036-B1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTPR LTD (GB) 2013-01-23 EP disclosed
EP-1691814-B1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTPR LTD (GB) 2012-07-25 EP disclosed
US-20120115742-A1 METHODS FOR IDENTIFICATION CAMBRIDGE ENTERPRISE LIMITED (GB) 2012-05-10 US disclosed
US-20120053076-A1 METHODS FOR IDENTIFICATION CAMBRIDGE ENTERPRISE LIMITED 2012-03-01 US disclosed
US-8076323-B2 Anti-inflammatory agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-12-13 US disclosed
EP-2279741-A2 Caprolactams and their use as anti-inflammatory agents Cambridge Enterprise Ltd. (GB) 2011-02-02 EP disclosed
US-20110003792-A1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTERPRISE LIMITED (GB) 2011-01-06 US disclosed
EP-1781299-B1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTPR LTD (GB) 2010-12-22 EP disclosed
US-20100292213-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-11-18 US disclosed
US-7803794-B2 Anti-inflammatory agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-09-28 US disclosed
US-7691845-B2 Anti-inflammatory agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-04-06 US disclosed
US-20100016286-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2010-01-21 US disclosed
US-20080227724-A1 3-(alkanoyl or alkenoyl)amino-caprolactams; autoimmune diseases, asthma, osteoporosis, transplant rejection, psoriasis, Alzheimer's Disease, Multiple sclerosis, ALS; antitumor, antiarthritic, antifibrotic, and antiscarring agents CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) 2008-09-18 US disclosed
US-20080194541-A1 Anti-Inflammatory Agents CAMBRIDGE ENTERPRISE LIMITED (GB) 2008-08-14 US disclosed
EP-1896036-A1 ANTI-INFLAMMATORY AGENTS Cambridge Enterprise Limited (GB) 2008-03-12 EP disclosed
WO-2006134384-A1 ANTI-INFLAMMATORY AGENTS CAMBRIDGE ENTERPRISE LIMITED (GB) 2006-12-21 WO disclosed
EP-1691814-A2 ANTI-INFLAMMATORY AGENTS CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) 2006-08-23 EP disclosed
WO-2005053702-A2 ANTI-INFLAMMATORY AGENTS CAMBRIDGE UNIVERSITY TECHNICAL SERVICES LIMITED (GB) 2005-06-16 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 (5 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-20100016286-A1 Anti-Inflammatory Agents TNF, LTC4S, IL6 DPP4 3257/4885DPP8 3969/4885DPP9 3926/4885
US-20080227724-A1 3-(alkanoyl or alkenoyl)amino-caprolactams; autoimmune diseases, asthma, osteoporosis, transplant rejection, psoriasis, Alzheimer's Disease, Multiple sclerosis, ALS; antitumor, antiarthritic, antifibrotic, and antiscarring agents SMURF1, SMURF2, PSEN1 DPP4 2946/4885DPP8 3384/4885DPP9 2274/4885
US-20080194541-A1 Anti-Inflammatory Agents TNF, IL1RN, FPR1 DPP4 1473/4885DPP8 1619/4885DPP9 1062/4885
US-20100292213-A1 Anti-Inflammatory Agents TNF, IL1RN, IL1R1 DPP4 1436/4885DPP8 1531/4885DPP9 1094/4885
US-20110003792-A1 ANTI-INFLAMMATORY AGENTS TNF, LTC4S, PTGS1 DPP4 2957/4885DPP8 3877/4885DPP9 3758/4885

“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.