SCHEMBL1908150

SCHEMBL1908150

O=C(CCN1CCC(Cc2ccc(F)cc2)CC1)c1ccc2[nH]c(=O)oc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 5/20 1.00
GRIN1 Q05586 5/20 1.00
GRIN2D O15399 3/20 1.00
GRIN3B O60391 3/20 1.00
GRIN2A Q12879 3/20 1.00
GRIN2C Q14957 3/20 1.00
GRIN3A Q8TCU5 3/20 1.00
ENPP2 Q13822 4/20 0.59
KCNH2 Q12809 1/20 0.54

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
SCHEMBL8546370 0.90 GRIN1 (0.82) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7528460 0.88 GRIN2B (0.79) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL109647 0.86 GRIN2B (0.76) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7418720 0.85 GRIN2B (0.74) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL3445998 0.84 GRIN2D (0.73) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL8542333 0.84 GRIN2B (0.73) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL8109942 0.84 GRIN1 (0.74) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7529124 0.83 GRIN2B (0.70) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL7531038 0.83 GRIN1 (0.70) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A
SCHEMBL4675791 0.82 GRIN1 (0.71) GRIN2BGRIN1GRIN2DGRIN3BGRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1649857-A2 New use of glutamate antagonists for the treatment of cancer Ikonomidou, Hrissanthi (DE) 2006-04-26 EP claimed
US-20050054650-A1 Use of glutamate antagonists for the treatment of cancer IKONOMIDOU HRISSANTHI (DE) 2005-03-10 US claimed
WO-2002030422-A1 USE OF DEFINED SUBSTANCES THAT BIND TO THE SIGMA RECEPTOR FOR COMBATING SARCOMA AND CARCINOMA MERCK PATENT GMBH (DE) 2002-04-18 WO claimed
EP-1124553-A1 NEW USE OF GLUTAMATE ANTAGONISTS FOR THE TREATMENT OF CANCER Ikonomidou, Hrissanthi (DE) 2001-08-22 EP claimed
EP-1002535-A1 New use of glutamate antagonists for the treatment of cancer Ikonomidou, Hrissanthi (DE) 2000-05-24 EP claimed
WO-2000024395-A1 NEW USE OF GLUTAMATE ANTAGONISTS FOR THE TREATMENT OF CANCER IKONOMIDOU HRISSANTHI (DE) 2000-05-04 WO claimed
EP-0938485-A1 BENZOXAZOLE DERIVATIVE WITH AN AFFINITY TO BINDING SITES OF AMINO ACID RECEPTORS MERCK PATENT GmbH (DE) 1999-09-01 EP claimed
WO-1998018793-A1 BENZOXAZOLE DERIVATIVE WITH AN AFFINITY TO BINDING SITES OF AMINO ACID RECEPTORS MERCK PATENT GMBH (DE) 1998-05-07 WO claimed
US-20130281523-A1 LOW DOSE CANNABINOID MEDICAMENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2013-10-24 US disclosed
EP-2640379-A2 LOW DOSE CANNABINOID MEDICAMENTS Pier Pharmaceuticals (US) 2013-09-25 EP disclosed
US-20120231083-A1 SUSTAINED RELEASE CANNABINOID MEDICAMENTS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-09-13 US disclosed
WO-2012068516-A2 LOW DOSE CANNABINOID MEDICAMENTS PIER PHARMACEUTICALS (US) 2012-05-24 WO disclosed
US-8178496-B2 Photoreactive regulator of glutamate receptor function and methods of use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-05-15 US disclosed
WO-2011063164-A2 SUSTAINED RELEASE CANNABINOID MEDICAMENTS STEADY SLEEP RX CO., INC. (US) 2011-05-26 WO disclosed
EP-0938485-A1 BENZOXAZOLE DERIVATIVE WITH AN AFFINITY TO BINDING SITES OF AMINO ACID RECEPTORS MERCK PATENT GmbH (DE) 1999-09-01 EP disclosed
EP-0938485-A1 BENZOXAZOLE DERIVATIVE WITH AN AFFINITY TO BINDING SITES OF AMINO ACID RECEPTORS MERCK PATENT GmbH (DE) 1999-09-01 EP disclosed
EP-0709384-B1 Benzylpiperidine derivatives having high affinity for binding sites of aminoacid receptors MERCK PATENT GMBH (DE) 1998-12-23 EP disclosed
WO-1998018793-A1 BENZOXAZOLE DERIVATIVE WITH AN AFFINITY TO BINDING SITES OF AMINO ACID RECEPTORS MERCK PATENT GMBH (DE) 1998-05-07 WO disclosed
WO-1998018793-A1 BENZOXAZOLE DERIVATIVE WITH AN AFFINITY TO BINDING SITES OF AMINO ACID RECEPTORS MERCK PATENT GMBH (DE) 1998-05-07 WO disclosed
EP-0709384-A1 Benzylpiperidine derivatives having high affinity for binding sites of aminoacid receptors MERCK PATENT GmbH (DE) 1996-05-01 EP disclosed