SCHEMBL1401433

SCHEMBL1401433

N[C@H]1C[C@H]2C[C@@H]1C[C@@H]2CC(=O)O

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 3/20 0.61
SLC6A11 P48066 3/20 0.61
SLC6A13 Q9NSD5 3/20 0.61
HSD11B1 P28845 1/20 0.38
GRM2 Q14416 2/20 0.35
GRM5 P41594 1/20 0.35
GRM1 Q13255 1/20 0.35
GABRR1 P24046 5/20 0.34
GABRR2 P28476 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
SCHEMBL1401434 1.00 SLC6A12 (0.61) SLC6A12SLC6A11SLC6A13HSD11B1GRM2
SCHEMBL27873533 0.77
SCHEMBL27873534 0.77
SCHEMBL18585427 0.77
SCHEMBL18585426 0.77
SCHEMBL18211107 0.75 SLC6A12 (0.45) SLC6A12SLC6A11SLC6A13HSD11B1
SCHEMBL3710957 0.73 HSD11B1 (0.60) SLC6A12SLC6A11SLC6A13HSD11B1GRM2
SCHEMBL23968806 0.71 SLC6A12 (0.41) SLC6A12SLC6A11SLC6A13HSD11B1
SCHEMBL7740219 0.70 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2GRM5
SCHEMBL3109773 0.70 SLC6A12 (0.60) SLC6A12SLC6A11SLC6A13GRM2GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1001945-B1 QUINOLINE AND QUINOXALINE COMPOUNDS WHICH INHIBIT PLATELET-DERIVED GROWTH FACTOR AND/OR p56lck TYROSINE KINASES AVENTIS PHARMA INC (US) 2011-03-02 EP disclosed
EP-1687642-B1 Screening methods for combinations of biological compounds CENTELION (FR) 2009-01-14 EP disclosed
US-20070197538-A1 Anti-vascular and anti-proliferation methods, therapies, and combinations employing specific tyrosine kinase inhibitors AVENTIS PHARMA S.A. (FR) 2007-08-23 US disclosed
EP-1687642-A2 ANTI-VASCULAR AND ANTI-PROLIFERATION METHODS, THERAPIES, AND COMBINATIONS EMPLOYING SPECIFIC TYROSINE KINASE INHIBITORS CENTELION (FR) 2006-08-09 EP disclosed
WO-2005038465-A2 ANTI-VASCULAR AND ANTI-PROLIFERATION METHODS, THERAPIES, AND COMBINATIONS EMPLOYING SPECIFIC TYROSINE KINASE INHIBITORS CENTELION (FR) 2005-04-28 WO disclosed
US-6852712-B2 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS INC. (US) 2005-02-08 US disclosed
US-6821962-B2 CONTROLLING CELL DIFFERENTIATION; ANTIINFLAMMATORY AGENTS AVENTIS PHARMACEUTICALS INC. 2004-11-23 US disclosed
US-6696434-B2 CONTROLLING CELL DIFFERENTIATION, CELL PROLIFERATION AVENTIS PHARMACEUTICALS INC. 2004-02-24 US disclosed
US-20030139399-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS INC. 2003-07-24 US disclosed
US-20030139400-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and /or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS PRODUCTS INC. 2003-07-24 US disclosed
US-20030130285-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS INC. 2003-07-10 US disclosed
US-6528526-B1 Inhibition of cell proliferation and/or cell matrix production and/or cell movement (chemotaxis) and/or T cell activation and proliferation AVENTIS PHARMACEUTICALS INC. 2003-03-04 US disclosed
US-6482834-B2 ANTIPROLIFERATION AGENTS; ANTICANCER AGENTS; ANTIINFLAMMATORY AGENTS AVENTIS PHARMACEUTICALS INC. 2002-11-19 US disclosed
US-20010023250-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-09-20 US disclosed
EP-1133480-A1 QUINOLINE AND QUINOXALINE COMPOUNDS AS PDGF-RECEPTOR AND/OR LCK TYROSINE KINASE INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2001-09-19 EP disclosed
US-6245760-B1 ANTICANCER AGENTS; ANTIINFLAMMATORYA GENTS; SKIN DISORDERS AVENTIS PHARMACEUTICALS PRODUCTS, INC 2001-06-12 US disclosed
US-6180632-B1 USE OF THESE COMPOUNDS FOR TREATING DISORDERS/CONDITIONS INVOLVING CELLULAR DIFFERENTIATION, PROLIFERATION, EXTRACELLULAR MATRIX PRODUCTION OR MEDIATOR RELEASE AND/OR T CELL ACTIVATION AND PROLIFERATION AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-01-30 US disclosed
WO-2000031051-A1 QUINOLINE AND QUINOXALINE COMPOUNDS AS PDGF-RECEPTOR AND/OR LCK TYROSINE KINASE INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-02 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-20030139400-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and /or p56lck tyrosine kinases LCK, LTK, PTK6 SLC6A12 4677/4885SLC6A11 4620/4885SLC6A13 4749/4885
US-20030130285-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases LCK, LTK, PTK6 SLC6A12 4677/4885SLC6A11 4620/4885SLC6A13 4749/4885
US-20070197538-A1 Anti-vascular and anti-proliferation methods, therapies, and combinations employing specific tyrosine kinase inhibitors MCL1, ABL1, TIE1 SLC6A12 4845/4885SLC6A11 4641/4885SLC6A13 4612/4885
US-20010023250-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases LCK, LTK, PTK6 SLC6A12 4677/4885SLC6A11 4620/4885SLC6A13 4749/4885
US-20030139399-A1 Quinoline and quinoxaline compounds which inhibit platelet-derived growth factor and/or p56lck tyrosine kinases LCK, LTK, PTK6 SLC6A12 4677/4885SLC6A11 4620/4885SLC6A13 4749/4885

“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.