SCHEMBL8235608

SCHEMBL8235608

CC(C)(C)N1CCC[C@@H]1C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.37
LMNA P02545 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 1/20 0.35
DPP4 P27487 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
AR P10275 1/20 0.33
FAP Q12884 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
ATM Q13315 1/20 0.32
EPHX1 P07099 1/20 0.32
PIK3CD O00329 2/20 0.32
PIK3CA P42336 2/20 0.32
PIK3CB P42338 2/20 0.32
PIK3CG P48736 2/20 0.32
PI4KB Q9UBF8 1/20 0.32
PIK3C2B O00750 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL4898829 1.00 HSD17B10 (0.37) HSD17B10LMNACYP2C19HTTDPP4
SCHEMBL10205021 1.00 HSD17B10 (0.37) HSD17B10LMNACYP2C19HTTDPP4
Hydrochloric Acid SCHEMBL7302950 0.98 HSD17B10 (0.36) HSD17B10LMNACYP2C19HTTDPP4
SCHEMBL4901400 0.94 EPHX1 (0.35) HSD17B10LMNACYP2C19HTTSMN1; SMN2
SCHEMBL10159973 0.88 HTT (0.42) HTTDPP4SMN1; SMN2ATMEPHX1
SCHEMBL22678726 0.88 HTT (0.42) HTTDPP4SMN1; SMN2ATMEPHX1
SCHEMBL1074624 0.86 DPP4 (0.38) HSD17B10LMNACYP2C19DPP4SMN1; SMN2
SCHEMBL5576808 0.82 DPP4 (0.35) HSD17B10LMNACYP2C19DPP4SMN1; SMN2
SCHEMBL17403515 0.82 HSD17B10 (0.38) HSD17B10LMNACYP2C19HTTDPP4
SCHEMBL10037292 0.82 HSD17B10 (0.49) HSD17B10LMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11746098-B2 Proteasome activity enhancing compounds PROTEOSTASIS THERAPEUTICS, INC. (US) 2023-09-05 US disclosed
US-11746098-B2 Proteasome activity enhancing compounds PROTEOSTASIS THERAPEUTICS, INC. (US) 2023-09-05 US disclosed
US-20210317127-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF CANCER ARAXES PHARMA LLC (US) 2021-10-14 US disclosed
US-20210188802-A1 PROTEASOME ACTIVITY ENHANCING COMPOUNDS PROTEOSTASIS THERAPEUTICS, INC. 2021-06-24 US disclosed
US-20170174713-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS GILEAD SCIENCES, INC. 2017-06-22 US disclosed
US-7851467-B2 Carbamate compounds as 5-HT4 receptor agonists THERAVANCE, INC. (US) 2010-12-14 US disclosed
US-7666877-B2 Ergoline derivatives NOVARTIS AG (CH) 2010-02-23 US disclosed
US-7534889-B2 For reduced motility of gastrointestinal tract; irritable bowel syndrome (IBS), chronic constipation, dyspepsia, reflux disease; 1-isopropyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid ((1S,3R,5R)-8-{3-[(2-ethylsulfanylethyl)methanesulfonylamino]-2-hydroxypropyl}-8-aza-bicyclo[3.2.1]oct-3-yl)amide THERAVANCE, INC. (US) 2009-05-19 US disclosed
US-20090018127-A1 Ergoline Derivatives NOVARTIS AG (CH) 2009-01-15 US disclosed
US-20080255187-A1 5-HT4 RECEPTOR AGONIST COMPOUNDS THERAVANCE BIOPHARMA R&D IP, LLC 2008-10-16 US disclosed
US-7399862-B2 5-HT4 receptor agonist compounds THERAVANCE, INC. (US) 2008-07-15 US disclosed
US-7399862-B2 5-HT4 receptor agonist compounds THERAVANCE, INC. (US) 2008-07-15 US disclosed
US-20080090811-A1 Carbamate compounds as 5-HT4 receptor agonists THERAVANCE BIOPHARMA R&D IP, LLC 2008-04-17 US disclosed
US-7329752-B2 Carbamate compounds as 5-HT4 receptor agonists THERAVANCE, INC. (US) 2008-02-12 US disclosed
US-20070117796-A1 Carbamate compounds as 5-HT4 receptor agonists THERAVANCE, INC. 2007-05-24 US disclosed
US-20060100236-A1 For therapy of disorder of reduced motility of gastrointestinal tract, chronic constipation, functional dyspepsia, delayed gastric emptying, gastroesophageal reflux disease, gastroparesis, diabetic and iodiopathic gastropathy, post-operative ileus, intestinal pseudo-obstruction, irritable bowel syndrome THERAVANCE, INC. (US) 2006-05-11 US disclosed
US-20060100236-A1 For therapy of disorder of reduced motility of gastrointestinal tract, chronic constipation, functional dyspepsia, delayed gastric emptying, gastroesophageal reflux disease, gastroparesis, diabetic and iodiopathic gastropathy, post-operative ileus, intestinal pseudo-obstruction, irritable bowel syndrome THERAVANCE, INC. (US) 2006-05-11 US 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 (9 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-11746098-B2 Proteasome activity enhancing compounds PSMG3, PSMC1, PSMB11 HSD17B10 2548/4885LMNA 2899/4885CYP2C19 4746/4885
US-20210188802-A1 PROTEASOME ACTIVITY ENHANCING COMPOUNDS PSMG3, PSMC1, PSMB11 HSD17B10 2548/4885LMNA 2899/4885CYP2C19 4746/4885
US-20090018127-A1 Ergoline Derivatives NR1H2, NR1H3, NR0B1 HSD17B10 307/4885LMNA 2348/4885CYP2C19 1543/4885
US-20070117796-A1 Carbamate compounds as 5-HT4 receptor agonists HTR4, HTR1A, HTR2B HSD17B10 2638/4885LMNA 4451/4885CYP2C19 228/4885
US-20080090811-A1 Carbamate compounds as 5-HT4 receptor agonists HTR4, HTR1A, HTR2B HSD17B10 2638/4885LMNA 4451/4885CYP2C19 228/4885
US-20080255187-A1 5-HT4 RECEPTOR AGONIST COMPOUNDS HTR4, HTR5A, HTR1A HSD17B10 2405/4885LMNA 3960/4885CYP2C19 386/4885
US-20060100236-A1 For therapy of disorder of reduced motility of gastrointestinal tract, chronic constipation, functional dyspepsia, delayed gastric emptying, gastroesophageal reflux disease, gastroparesis, diabetic and iodiopathic gastropathy, post-operative ileus, intestinal pseudo-obstruction, irritable bowel syndrome GIPR, GPR4, GPR119 HSD17B10 3893/4885LMNA 4857/4885CYP2C19 632/4885
US-20210317127-A1 HETEROCYCLIC SPIRO COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF CANCER KRAS, NRAS, HRAS HSD17B10 4113/4885LMNA 287/4885CYP2C19 2713/4885
US-20170174713-A1 TANK-BINDING KINASE INHIBITOR COMPOUNDS TBKBP1, TNKS1BP1, TNKS HSD17B10 3487/4885LMNA 2240/4885CYP2C19 4871/4885

“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.