SCHEMBL788096

SCHEMBL788096

O=C(O)c1nc2ncncc2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.43
METAP1 P53582 1/20 0.43
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
PTPRB P23467 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PIN1 Q13526 2/20 0.39
HCAR2 Q8TDS4 1/20 0.36
ENPP1 P22413 1/20 0.36
LMNA P02545 1/20 0.36
GRIN2B Q13224 5/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
DAGLA Q9Y4D2 1/20 0.33
ITGB3 P05106 1/20 0.32
ITGAV P06756 1/20 0.32
NPY5R Q15761 1/20 0.32
RHEB Q15382 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
SCHEMBL5349501 0.86 METAP2 (0.43) METAP2METAP1ENPP1GRIN2BPTGDR2
Hypoxanthine SCHEMBL10718864 0.85 ALDH1A1 (0.46) METAP2METAP1
SCHEMBL7771672 0.84 METAP2 (0.42) METAP2METAP1ENPP1GRIN2BPTGDR2
SCHEMBL788792 0.84 METAP2 (0.42) METAP2METAP1ENPP1GRIN2BPTGDR2
SCHEMBL4521139 0.84 METAP2 (0.42) METAP2METAP1ENPP1GRIN2BPTGDR2
SCHEMBL19207483 0.80 METAP2 (0.39) METAP2METAP1ENPP1GRIN2BPTGDR2
SCHEMBL28203630 0.78 METAP2 (0.38) METAP2METAP1ENPP1GRIN2B
SCHEMBL7576752 0.77 METAP2 (0.42) METAP2METAP1ENPP1NPY5R
SCHEMBL14125937 0.77 KDM4E (0.46) METAP2METAP1KDM4ECYP2C9HSD17B10
SCHEMBL18114688 0.74 KDM4E (0.46) KDM4ECYP3A4CYP2C9PTPRBHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114253040-A Light modulation device 江苏集萃智能液晶科技有限公司 2022-03-29 CN claimed
CN-106543183-A The synthetic method of 2,3 dibromo of medical body, 5 methyl purine, 6 carboxylic acid, ethyl ester 无锡乾浩生物医药有限公司 2017-03-29 CN claimed
CN-104193745-B A kind of imidazopyrimidine carboxylic acid compound and preparation method thereof 斯芬克司药物研发(天津)股份有限公司 2016-09-28 CN claimed
CN-104193745-A Imidazolopyrimidine carboxylic acid type compound and preparation method thereof SPHINX SCIENT LAB CORP 2014-12-10 CN claimed
EP-2616469-A1 INHIBITORS OF PI3K-DELTA AND METHODS OF THEIR USE AND MANUFACTURE Exelixis, Inc. (US) 2013-07-24 EP claimed
WO-2012037226-A1 INHIBITORS OF PI3K-DELTA AND METHODS OF THEIR USE AND MANUFACTURE EXELIXIS, INC. (US) 2012-03-22 WO claimed
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
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
EP-0701446-A4 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORP (US) 1997-04-23 EP claimed
EP-0621788-A4 HEMOREGULATORY PEPTIDES. SMITHKLINE BEECHAM CORP (US) 1997-03-05 EP claimed
EP-0725651-A4 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORP (US) 1997-03-05 EP claimed
EP-0725651-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1996-08-14 EP claimed
EP-0701446-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1996-03-20 EP claimed
WO-1995011693-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1995-05-04 WO claimed
WO-1994027627-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1994-12-08 WO claimed
EP-0621788-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1994-11-02 EP claimed
CN-1077960-A HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORP (US) 1993-11-03 CN claimed
WO-1993013789-A1 HEMOREGULATORY PEPTIDES SMITHKLINE BEECHAM CORPORATION (US) 1993-07-22 WO claimed