SCHEMBL5048181

SCHEMBL5048181

Nc1nc2nc[nH]c2c(=O)n1CC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PNP P00491 2/20 0.45
PDE4A P27815 7/20 0.43
PDE4B Q07343 7/20 0.43
PDE4C Q08493 7/20 0.43
PDE4D Q08499 7/20 0.43
MGMT P16455 2/20 0.40
DPP4 P27487 1/20 0.40
CDK2 P24941 1/20 0.39
ADORA2A P29274 3/20 0.39
ADORA2B P29275 3/20 0.39
PDPK1 O15530 1/20 0.38
GDA Q9Y2T3 1/20 0.38

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
SCHEMBL6265343 0.87 PDE4A (0.55) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL6267430 0.84 PNP (0.45) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL6268093 0.84 ADORA2A (0.42) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL1047660 0.84 PNP (0.45) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL28071828 0.84 PNP (0.45) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL6265538 0.83 MGMT (0.47) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL8343189 0.81 PDE4A (0.35) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL6266783 0.81 MGMT (0.49) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL27842808 0.81 PDE4A (0.53) PNPPDE4APDE4BPDE4CPDE4D
SCHEMBL6271705 0.81 CDK1 (0.52) PNPPDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110013441-A For the salicylic aqueous solution of solubilising, preparation method and include its cosmetic composition 株式会社爱茉莉太平洋 2019-07-16 CN claimed
EP-0792283-A1 SYNTHESIS OF PEPTIDE NUCLEIC ACIDS (PNAs) AND ANALOGUES VIA SUBMONOMER APPROACH CHIRON CORPORATION (US) 1997-09-03 EP claimed
WO-1996015143-A1 SYNTHESIS OF PEPTIDE NUCLEIC ACIDS (PNAs) AND ANALOGUES VIA SUBMONOMER APPROACH CHIRON CORPORATION (US) 1996-05-23 WO claimed
CN-110013441-A For the salicylic aqueous solution of solubilising, preparation method and include its cosmetic composition 株式会社爱茉莉太平洋 2019-07-16 CN disclosed
CN-107951765-A Purple bamboo shoot tea extraction and its application 欧诗漫生物股份有限公司 2018-04-24 CN disclosed
CN-107530263-A For reducing the drying time of hair and improving the composition of its pliability 株式会社爱茉莉太平洋 2018-01-02 CN disclosed
CN-107427434-A Promote the composition comprising genistein or Epigallo-catechin gallate (EGCG) of cell rejuvenation for inducing 株式会社爱茉莉太平洋 2017-12-01 CN disclosed
CN-107412031-A Dermatologic preparation composition containing orange peel element 株式会社爱茉莉太平洋 2017-12-01 CN disclosed
CN-103222930-B Composition for external application containing tangeretin and epigallocatechin 株式会社爱茉莉太平洋 2017-08-29 CN disclosed
CN-106999527-A For preventing hair loss or stimulating the composition for including umbel parthenium extract of natural on-off cycles of hair growth 株式会社爱茉莉太平洋 2017-08-01 CN disclosed
CN-106999528-A For preventing hair loss or stimulating the composition for including high mountain radix scutellariae extract of natural on-off cycles of hair growth 株式会社爱茉莉太平洋 2017-08-01 CN disclosed
CN-103889397-B Cosmetic composition containing green tea component 株式会社爱茉莉太平洋 2017-05-10 CN disclosed
EP-1873156-A1 Process for the preparation of 6-[[(alkoxy)carbonyl]amino]-9H-Purine-9-acetic acid and 4-[(alkoxycarbonyl)amino]-2-oxo-1(2H)-Pyrimidineacetic acid derivatives as synthons for the synthesis of peptide nucleic acids PerSeptive Biosystems, Inc. (US) 2008-01-02 EP disclosed
EP-0736027-B1 GUANINE SYNTHONS FOR PEPTIDE NUCLEIC ACID SYNTHESIS AND METHOD FOR PRODUCTION PERSEPTIVE BIOSYSTEMS INC (US) 2002-05-29 EP disclosed
US-6172226-B1 Synthons for the synthesis and deprotection of peptide nucleic acids under mild conditions PERSEPTIVE BIOSYSTEMS, INC. 2001-01-09 US disclosed
US-6133444-A PURINE PEPTIDE NUCLEIC ACIDS SYNTHONS PERSEPTIVE BIOSYSTEMS, INC. (US) 2000-10-17 US disclosed
EP-0840736-A1 IMPROVED SYNTHONS FOR THE SYNTHESIS AND DEPROTECTION OF PEPTIDE NUCLEIC ACIDS UNDER MILD CONDITIONS PerSeptive Biosystems, Inc. (US) 1998-05-13 EP disclosed
WO-1996040685-A1 IMPROVED SYNTHONS FOR THE SYNTHESIS AND DEPROTECTION OF PEPTIDE NUCLEIC ACIDS UNDER MILD CONDITIONS PERSEPTIVE BIOSYSTEMS, INC. (US) 1996-12-19 WO disclosed
EP-0736027-A1 GUANINE SYNTHONS FOR PEPTIDE NUCLEIC ACID SYNTHESIS AND METHOD FOR PRODUCTION PERSEPTIVE BIOSYSTEMS, INC. (US) 1996-10-09 EP disclosed
WO-1995017403-A1 GUANINE SYNTHONS FOR PEPTIDE NUCLEIC ACID SYNTHESIS AND METHOD FOR PRODUCTION PERSEPTIVE BIOSYSTEMS, INC. (US) 1995-06-29 WO disclosed