SCHEMBL377976

SCHEMBL377976

CC(=O)N1C(C)CNCC1C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 15/20 0.46
CHRNA3 P32297 15/20 0.46
CHRNA4 P43681 15/20 0.46
CHRNB4 P30926 14/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
CHRNA7 P36544 12/20 0.43
HTR2C P28335 2/20 0.42
CHRNB3 Q05901 1/20 0.33
CHRNA6 Q15825 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2B P41595 1/20 0.33

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
SCHEMBL18081172 1.00 CHRNB2 (0.46) CHRNB2CHRNA3CHRNA4CHRNB4SMN1; SMN2
SCHEMBL1481267 1.00 CHRNB2 (0.46) CHRNB2CHRNA3CHRNA4CHRNB4SMN1; SMN2
Hydrochloric Acid SCHEMBL1480990 0.98 CHRNB2 (0.45) CHRNB2CHRNA3CHRNA4CHRNB4SMN1; SMN2
Hydrochloric Acid SCHEMBL15956717 0.98 CHRNB2 (0.45) CHRNB2CHRNA3CHRNA4CHRNB4SMN1; SMN2
SCHEMBL7050116 0.88 HTR2C (0.46) CHRNB2CHRNA3CHRNA4CHRNB4SMN1; SMN2
SCHEMBL28949604 0.80 HTR2C (0.46) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL26334441 0.80 HTR2C (0.46) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL6368277 0.80 HTR2C (0.46) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL2379324 0.80 HTR2C (0.46) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7
SCHEMBL2846979 0.80 HTR2C (0.46) CHRNB2CHRNA3CHRNA4CHRNB4CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408454-B1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP (CA) 2024-07-24 EP disclosed
US-11407719-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2022-08-09 US disclosed
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2021-03-11 US disclosed
US-10882828-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2021-01-05 US disclosed
EP-3313397-B1 PURINE INHIBITORS OF HUMAN PHOSPHATIDYLINOSITOL 3-KINASE DELTA MERCK SHARP & DOHME (US) 2020-11-25 EP disclosed
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2019-04-25 US disclosed
US-10221178-B2 Purine inhibitors of human phosphatidylinositol 3-kinase delta MERCK SHARP & DOHME CORP. (US) 2019-03-05 US disclosed
US-10131640-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2018-11-20 US disclosed
US-20180141947-A1 Purine Inhibitors of Human Phosphatidylinositol 3-Kinase Delta MERCK SHARP & DOHME CORP. (US) 2018-05-24 US disclosed
EP-1632477-B1 BENZAMIDE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2017-03-01 EP disclosed
EP-2532667-A1 Deazapurines useful as inhibitors of janus kinases Vertex Pharmaceuticals Incorporated (US) 2012-12-12 EP disclosed
EP-1931674-B1 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMA (US) 2012-12-12 EP disclosed
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS HEPALINK (HONG KONG) LIMITED (HK) 2012-02-16 US disclosed
EP-2408454-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2012-01-25 EP disclosed
WO-2010106436-A2 NOVEL ANTI-INFLAMMATORY AGENTS RESVERLOGIX CORP. (CA) 2010-09-23 WO disclosed
US-7521441-B2 Cyclopropyl fused indolobenzazepine HCV NS5B inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-04-21 US disclosed
EP-1931674-A2 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES Vertex Pharmceuticals Incorporated (US) 2008-06-18 EP disclosed
US-20070270406-A1 Cyclopropyl Fused Indolobenzazepine HCV NS5B Inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-11-22 US disclosed
US-20070207995-A1 Deazapurines useful as inhibitors of Janus kinases VERTEX PHARMACEUTICALS INCORPORATED 2007-09-06 US disclosed
WO-2007041130-A2 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-04-12 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 (10 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-11407719-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CHRNB2 2672/4885CHRNA3 1862/4885CHRNA4 1993/4885
US-10882828-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CHRNB2 2672/4885CHRNA3 1862/4885CHRNA4 1993/4885
US-20070270406-A1 Cyclopropyl Fused Indolobenzazepine HCV NS5B Inhibitors HAVCR2, ZC3HAV1, HCCS CHRNB2 4197/4885CHRNA3 3926/4885CHRNA4 4180/4885
US-20210070716-A1 ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CHRNB2 2672/4885CHRNA3 1862/4885CHRNA4 1993/4885
US-10131640-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 CHRNB2 2672/4885CHRNA3 1862/4885CHRNA4 1993/4885
US-10221178-B2 Purine inhibitors of human phosphatidylinositol 3-kinase delta PIK3CD, PIK3CA, PI4KA CHRNB2 1216/4885CHRNA3 820/4885CHRNA4 1196/4885
US-20070207995-A1 Deazapurines useful as inhibitors of Janus kinases JAK1, JAK3, JAK2 CHRNB2 4878/4885CHRNA3 4837/4885CHRNA4 4866/4885
US-20180141947-A1 Purine Inhibitors of Human Phosphatidylinositol 3-Kinase Delta PIK3CD, PIK3CA, PI4KA CHRNB2 1216/4885CHRNA3 820/4885CHRNA4 1196/4885
US-20190119222-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CHRNB2 2564/4885CHRNA3 1693/4885CHRNA4 1848/4885
US-20120040954-A1 NOVEL ANTI-INFLAMMATORY AGENTS VCAM1, ICAM1, IL6 CHRNB2 2564/4885CHRNA3 1693/4885CHRNA4 1848/4885

“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.