SCHEMBL887882

SCHEMBL887882

CONc1nc(N)nc2[nH]cnc12

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 6/20 0.39
MAP3K5 Q99683 2/20 0.35
CDK1 P06493 6/20 0.33
CDK2 P24941 6/20 0.33
CCNB1 P14635 5/20 0.33
CCNA2 P20248 5/20 0.33
CCNA1 P78396 5/20 0.33
PDPK1 O15530 1/20 0.33
GDA Q9Y2T3 1/20 0.33
CHUK O15111 1/20 0.32
EIF2AK2 P19525 1/20 0.32
PIN1 Q13526 1/20 0.31
DPP4 P27487 1/20 0.31
PRKACA P17612 1/20 0.31

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
SCHEMBL6509982 0.81
SCHEMBL129817 0.81 CHUK (0.44) BRAFMAP3K5CDK1CDK2PDPK1
SCHEMBL8485064 0.79 PDPK1 (0.36) BRAFMAP3K5CDK1CDK2PDPK1
SCHEMBL20093433 0.77 CDK2 (0.37) BRAFMAP3K5CDK1CDK2PDPK1
SCHEMBL2938904 0.77 BRAF (0.36) BRAFCDK1CDK2PDPK1GDA
SCHEMBL5699105 0.77 HTT (0.36) PDPK1
SCHEMBL9168808 0.77 APP (0.44) BRAFMAP3K5CDK1CDK2CCNB1
SCHEMBL8348019 0.77 NLRP3 (0.40) BRAFCDK1CDK2CCNB1CCNA2
Methylguanine SCHEMBL7217769 0.76 BRAF (0.37) BRAFMAP3K5CDK1CDK2CCNB1
Methylguanine SCHEMBL29968306 0.76 CDK1 (0.41) BRAFCDK1CDK2CCNB1CCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021360-A1 Compositions, formulations and kit with anti-sense oligonucleotide and anti-inflammatory steroid and/or obiquinone for treatment of respiratory and lung disesase EPIGENESIS PHARMACEUTICALS, LLC 2007-01-25 US claimed
EP-1171634-B1 AMPLIFICATION AND SEQUENCING PRIMER PAIRS AND USE THEREOF GEN PROBE INC (US) 2005-10-26 EP claimed
US-20040049022-A1 Composition & methods for treatment and screening NYCE JONATHAN W (US) 2004-03-11 US claimed
JP-2003517428-A 2003-05-27 JP claimed
US-20030087845-A1 COMPOSITION, FORMULATIONS & METHOD FOR PREVENTION & TREATMENT OF DISEASES AND CONDITIONS ASSOCIATED WITH BRONCHOCONSTRICTION, ALLERGY(IES) & INFLAMMATION EPIGENESIS PHARMACEUTICALS, INC. 2003-05-08 US claimed
WO-2002085309-A2 COMPOSITION, FORMULATIONS & KITS FOR TREATMENT OF RESPIRATORY & LUNG DISEASE WITH ANTI-SENSE OLIGONUCLEOTIDES & A BRONCHODILATING AGENT EPIGENESIS PHARMACEUTICALS, INC. (US) 2002-10-31 WO claimed
EP-1011608-A4 COMPOSITION AND METHOD FOR PREVENTION AND TREATMENT OF CARDIOPULMONARY AND RENAL FAILURE OR DAMAGE ASSOCIATED WITH ISCHEMIA, ENDOTOXIN RELEASE, ARDS OR BROUGHT ABOUT BY ADMINISTRATION OF CERTAIN DRUGS EPIGENESIS PHARMACEUTICALS INC (US) 2002-05-15 EP claimed
US-6376183-B1 HYBRIDIZING PRIMER TO TARGET AND EFFECTING CHAIN EXTENSION/CHAIN TERMINATION, USING PRIMER SELECTED FROM PRESYNTHESISED SET OF WALKING PRIMERS OF WHICH ANNEALING TEMPERATURES ARE RAISED AND/OR ANNEALING PROPERTIES IMPROVED AMERSHAM PHARMACIA BIOTECH UK LIMITED (GB) 2002-04-23 US claimed
EP-1019065-A4 MULTIPLE TARGET HYBRIDIZING NUCLEIC ACIDS, THEIR PREPARATION, COMPOSITIONS, FORMULATION, KITS AND APPLICATIONS UNIV EAST CAROLINA (US) 2002-02-20 EP claimed
CN-1330513-A Low adenosine antisense oligonucleotides, compositions, kits and methods for treating airway disorders associated with bronchoconstriction, pneumonia, allergy and surfactant deficiency UNIV EAST CAROLINA (US) 2002-01-09 CN claimed
EP-1019065-A1 MULTIPLE TARGET HYBRIDIZING NUCLEIC ACIDS, THEIR PREPARATION, COMPOSITIONS, FORMULATION, KITS AND APPLICATIONS EAST CAROLINA UNIVERSITY (US) 2000-07-19 EP claimed
EP-1011608-A2 COMPOSITION AND METHOD FOR PREVENTION AND TREATMENT OF CARDIOPULMONARY AND RENAL FAILURE OR DAMAGE ASSOCIATED WITH ISCHEMIA, ENDOTOXIN RELEASE, ARDS OR BROUGHT ABOUT BY ADMINISTRATION OF CERTAIN DRUGS Epigenesis Pharmaceuticals, Inc. (US) 2000-06-28 EP claimed
US-6074818-A GENERATING PROFILES OF INCREASED FIDELITY USING OLIGONUCLEOTIDE PRIMERS WITH HAIRPIN STRUCTURES THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2000-06-13 US claimed
US-6043059-A PERFORMING SERIES OF REACTIONS INVOLVING HYBRIDIZING PRIMER TO TARGET AND EFFECTING CHAIN EXTENSION/CHAIN TERMINATION; USING PRIMER FROM PRESYNTHESIZED SET HAVING RAISED ANNEALING TEMPERATURE AND/OR IMPROVED ANNEALING PROPERTIES AMERSHAM PHARMACIA BIOTECH UK (GB) 2000-03-28 US claimed
WO-1999063938-A9 COMPOSITION AND METHOD FOR PREVENTION AND TREATMENT OF CARDIOPULMONARY AND RENAL FAILURE OR DAMAGE ASSOCIATED WITH ISCHEMIA, ENDOTOXIN RELEASE, ARDS OR BROUGHT ABOUT BY ADMINISTRATION OF CERTAIN DRUGS EPIGENESIS PHARMACEUTICALS INC (US) 2000-03-02 WO claimed
WO-1999063938-A2 COMPOSITION AND METHOD FOR PREVENTION AND TREATMENT OF CARDIOPULMONARY AND RENAL FAILURE OR DAMAGE ASSOCIATED WITH ISCHEMIA, ENDOTOXIN RELEASE, ARDS OR BROUGHT ABOUT BY ADMINISTRATION OF CERTAIN DRUGS EPIGENESIS PHARMACEUTICALS, INC. (US) 1999-12-16 WO claimed
US-5962221-A Oligonucleotide constructs and methods for the generation of sequence signatures from nucleic acids UNIVERSITY OF TENNESSEE RESEARCH CORPORATION, THE 1999-10-05 US claimed
WO-1999013886-A1 MULTIPLE TARGET HYBRIDIZING NUCLEIC ACIDS, THEIR PREPARATION, COMPOSITIONS, FORMULATION, KITS AND APPLICATIONS EAST CAROLINA UNIVERSITY (US) 1999-03-25 WO claimed
EP-0837950-A1 PRIMER WALKING CYCLE SEQUENCING Amersham Life Science (GB) 1998-04-29 EP claimed
WO-1997001645-A1 PRIMER WALKING CYCLE SEQUENCING AMERSHAM LIFE SCIENCE (GB) 1997-01-16 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20030087845-A1 COMPOSITION, FORMULATIONS & METHOD FOR PREVENTION & TREATMENT OF DISEASES AND CONDITIONS ASSOCIATED WITH BRONCHOCONSTRICTION, ALLERGY(IES) & INFLAMMATION ADORA2B, ADORA2A, ADORA3 BRAF 1470/4885MAP3K5 3668/4885CDK1 2436/4885
US-20070021360-A1 Compositions, formulations and kit with anti-sense oligonucleotide and anti-inflammatory steroid and/or obiquinone for treatment of respiratory and lung disesase RECQL, GSS, DDX17 BRAF 2862/4885MAP3K5 1506/4885CDK1 1288/4885

“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.