SCHEMBL4357939

SCHEMBL4357939

CCOC(=O)ON1c2ccccc2C=CC1OCC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.67
LMNA P02545 1/20 0.67
MAPK1 P28482 3/20 0.38
P2RX4 Q99571 6/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 2/20 0.36
P2RX1 P51575 3/20 0.36
P2RX3 P56373 3/20 0.36
P2RX7 Q99572 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
BCHE P06276 1/20 0.36
PTBP1 P26599 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MTNR1A P48039 2/20 0.35
MTNR1B P49286 2/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL7000034 0.81 SMN1; SMN2 (0.59) SMN1; SMN2LMNAMAPK1P2RX4MEN1
SCHEMBL367474 0.80 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMAPK1P2RX4MEN1
SCHEMBL338 0.80 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMAPK1P2RX4MEN1
SCHEMBL23705539 0.80 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMAPK1P2RX4MEN1
SCHEMBL29367804 0.80 SMN1; SMN2 (1.00) SMN1; SMN2LMNAMAPK1P2RX4MEN1
SCHEMBL5555646 0.77 SMN1; SMN2 (0.67) SMN1; SMN2LMNAMAPK1P2RX4MEN1
Carbimide SCHEMBL10800076 0.76 SMN1; SMN2 (0.90) SMN1; SMN2LMNAMAPK1P2RX4MEN1
1,2-Dichloroethane SCHEMBL28697158 0.76 SMN1; SMN2 (0.90) SMN1; SMN2LMNAMAPK1P2RX4MEN1
SCHEMBL30563642 0.76 SMN1; SMN2 (0.78) SMN1; SMN2LMNAMAPK1P2RX4MEN1
SCHEMBL4742545 0.76 SMN1; SMN2 (0.78) SMN1; SMN2LMNAMAPK1P2RX4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2089362-A1 METAL CHELATES HAVING A PERFLUORINATED PEG GROUP, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF Bayer Schering Pharma Aktiengesellschaft (DE) 2009-08-19 EP disclosed
WO-2008046463-A1 METAL CHELATES HAVING A PERFLUORINATED PEG GROUP, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-04-24 WO disclosed
EP-1904462-A2 COMPLEXES CONTAINING PERFLUOROALKYL, METHOD FOR THE PRODUCTION AND USE THEREOF Bayer Schering Pharma Aktiengesellschaft (DE) 2008-04-02 EP disclosed
EP-1307237-B9 COMPLEXES CONTAINING PERFLUOROALKYL WITH POLAR RADICALS, METHOD FOR THE PRODUCTION AND USE THEREOF BAYER SCHERING PHARMA AG (DE) 2008-01-09 EP disclosed
EP-1088558-B1 Galenic formulations comprising paramagnetic and diamagnetic compounds BAYER SCHERING PHARMA AG (DE) 2007-06-27 EP disclosed
EP-1307237-B1 COMPLEXES CONTAINING PERFLUOROALKYL WITH POLAR RADICALS, METHOD FOR THE PRODUCTION AND USE THEREOF BAYER SCHERING PHARMA AG (DE) 2007-04-11 EP disclosed
WO-2007009637-A2 COMPLEXES CONTAINING PERFLUOROALKYL, THEIR USE AS CONTRAST MEDIA FOR NMR, X-RAY AND RADIO DIAGNOSIS AND RADIOTHERAPY BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-25 WO disclosed
EP-1210335-B1 AMINOCARBONYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES, METHOD FOR PRODUCING SAME AND THE USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2005-09-14 EP disclosed
EP-1237877-B1 CARBOXAMIDE-SUBSTITUTED BENZIMIDAZOL DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2005-07-27 EP disclosed
EP-1307446-B1 PERFLUOROALKYL-CONTAINING COMPLEXES COMPRISING SUGAR RESIDUES, METHOD FOR PRODUCING THE SAME AND USE THEREOF SCHERING AG (DE) 2005-04-20 EP disclosed
EP-0697023-B1 3-(AMINOACYL-AMINO)-SACCHARIDES AND METHOD FOR PREPARING THEM ZUCKERINDUSTRIE VEREIN (DE) 1998-11-25 EP disclosed
EP-0773934-A1 HERBICIDAL PYRAZINE DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1997-05-21 EP disclosed
EP-0489423-B1 Bile-acid derivatives, a process for their preparation and their use as medicines HOECHST AG (DE) 1996-11-06 EP disclosed
EP-0697023-A1 3-(AMINOACYL-AMINO)-SACCHARIDES AND METHOD FOR PREPARING THEM VEREIN DER ZUCKERINDUSTRIE (DE) 1996-02-21 EP disclosed
EP-0576949-B1 Optically active amino acid sulphoxide and sulphone derivatives, their preparation, their polymerisation and use as adsorbents for chromatograpic separation of racemates BAYER AG (DE) 1996-01-31 EP disclosed
WO-1994025474-A1 3-(AMINOACYL-AMINO)-SACCHARIDES AND METHOD FOR PREPARING THEM VEREIN DER ZUCKERINDUSTRIE (DE) 1994-11-10 WO disclosed
EP-0576949-A1 Optically active amino acid sulphoxide and sulphone derivatives, their preparation, their polymerisation and use as adsorbents for chromatograpic separation of racemates BAYER AG (DE) 1994-01-05 EP disclosed
EP-0548793-A2 Ethylenic-unsaturated bile acid derivatives, process for their production and preliminary processes therefor HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
EP-0489423-A1 Bile-acid derivatives, a process for their preparation and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1992-06-10 EP disclosed
EP-0363856-A1 Derivative of coumarin, process for its preparation and its use HOECHST AKTIENGESELLSCHAFT (DE) 1990-04-18 EP disclosed