SCHEMBL94363

SCHEMBL94363

CSc1nc(N)nc2nc[nH]c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 1/20 1.00
PDPK1 O15530 1/20 0.59
GDA Q9Y2T3 1/20 0.59
NUDT1 P36639 2/20 0.57
PIN1 Q13526 2/20 0.56
POLB P06746 1/20 0.56
CDK2 P24941 7/20 0.56
HSD17B10 Q99714 2/20 0.56
TP53 P04637 2/20 0.56
DPP4 P27487 1/20 0.56
CYP1A2 P05177 4/20 0.56
CYP2C19 P33261 4/20 0.55
CYP3A4 P08684 3/20 0.55
CYP2D6 P10635 2/20 0.55
CYP2C9 P11712 2/20 0.55
ALDH1A1 P00352 2/20 0.55
TOP2A P11388 1/20 0.55
HPGD P15428 1/20 0.55
HIF1A Q16665 1/20 0.55
CDK1 P06493 6/20 0.51

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
SCHEMBL9346526 0.84 MAP3K5 (0.72) MAP3K5PDPK1GDANUDT1PIN1
SCHEMBL16758710 0.81 MAP3K5 (0.69) MAP3K5PDPK1GDANUDT1PIN1
SCHEMBL10410696 0.80 MAP3K5 (0.67) MAP3K5PDPK1GDANUDT1PIN1
SCHEMBL887133 0.79 MAP3K5 (0.65) MAP3K5PDPK1GDAPIN1POLB
SCHEMBL2891519 0.78 MAP3K5 (0.64) MAP3K5PDPK1GDANUDT1PIN1
SCHEMBL6318896 0.77 MAP3K5 (0.61) MAP3K5PDPK1GDANUDT1PIN1
SCHEMBL4453628 0.76 MAP3K5 (0.58) MAP3K5PDPK1GDANUDT1PIN1
2,6-Diaminopurine SCHEMBL29143272 0.76 PDPK1 (0.92) MAP3K5PDPK1GDAPIN1CDK2
SCHEMBL432161 0.76 PAK1 (0.66) MAP3K5PDPK1GDANUDT1PIN1
SCHEMBL320850 0.76 PDPK1 (0.66) MAP3K5PDPK1GDAPIN1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118931997-A Method for synthesizing adenosine and/or uridine by three-enzyme cascade catalysis 上海飞腾医药科技有限公司 2024-11-12 CN claimed
US-20220273689-A1 POTENTIATION OF ANTIVIRAL NUCLEOBASES AS RNA VIRUS THERAPY REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2022-09-01 US claimed
WO-2021007283-A1 POTENTIATION OF ANTIVIRAL NUCLEOBASES AS RNA VIRUS THERAPY REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2021-01-14 WO claimed
EP-2177606-A2 N-deoxyribosyltransferases from lactobacillus, corresponding nucleotide sequences and their applications INSTITUT PASTEUR (FR) 2010-04-21 EP claimed
EP-1427819-B1 LACTOBACILLUS N-DEOXYRIBOSYL TRANSFERASES, CORRESPONDING NUCLEOTIDE SEQUENCES AND THEIR USES PASTEUR INSTITUT (FR) 2009-12-23 EP claimed
US-20080280329-A1 Enzymatic synthesis of deoxyribonucleosides TISCHER WILHELM 2008-11-13 US claimed
US-20080250513-A1 LACTOBACILLUS N-DEOXYRIBOSYL TRANSFERASES, CORRESPONDING NUCLEOTIDE SEQUENCES AND THEIR USES INSTITUT PASTEUR (FR) 2008-10-09 US claimed
CN-101217999-A Personal care compositions and methods for the beautification of mammalian skin and hair PROCTER & GAMBLE (US) 2008-07-09 CN claimed
EP-1901817-A2 PERSONAL CARE COMPOSITIONS AND METHODS FOR THE BEAUTIFICATION OF MAMMALIAN SKIN AND HAIR The Procter and Gamble Company (US) 2008-03-26 EP claimed
WO-2007007255-A2 PERSONAL CARE COMPOSITIONS AND METHODS FOR THE BEAUTIFICATION OF MAMMALIAN SKIN AND HAIR THE PROCTER & GAMBLE COMPANY (US) 2007-01-18 WO claimed
EP-0626387-A1 Nucleosides and oligonucleotides with 2'-ether groups CIBA-GEIGY AG (CH) 1994-11-30 EP claimed
EP-0612994-A2 Matrix for matrix-assisted laser desorption mass spectroscopy CIBA-GEIGY AG (CH) 1994-08-31 EP claimed
US-5332814-A Process for the preparation of carbacyclic nucleosides, and intermediates CIBA-GEIGY CORPORATION (US) 1994-07-26 US claimed
US-5319080-A Antiviral agents CIBA-GEIGY CORPORATION (US) 1994-06-07 US claimed
EP-0577558-A2 Carbocyclic nucleosides having bicyclic rings, oligonucleotides therefrom, process for their preparation, their use and intermediates CIBA-GEIGY AG (CH) 1994-01-05 EP claimed
EP-0540686-A4 2'-FLUOROFURANOSYL DERIVATIVES AND NOVEL METHOD OF PREPARING 2'-FLUOROPYRIMIDINE AND 2'-FLUOROPURINE NUCLEOSIDES US COMMERCE (US) 1993-05-26 EP claimed
EP-0542681-A1 Process for the preparation of carbocyclic nucleosides and its intermediates CIBA-GEIGY AG (CH) 1993-05-19 EP claimed
EP-0540686-A1 2'-FLUOROFURANOSYL DERIVATIVES AND NOVEL METHOD OF PREPARING 2'-FLUOROPYRIMIDINE AND 2'-FLUOROPURINE NUCLEOSIDES. US COMMERCE (US) 1993-05-12 EP claimed
EP-0538194-A1 Bicyclic nucleosides, oligonucleotides, their method of preparation and intermediates therein CIBA-GEIGY AG (CH) 1993-04-21 EP claimed
WO-1992001700-A1 2'-FLUOROFURANOSYL DERIVATIVES AND NOVEL METHOD OF PREPARING 2'-FLUOROPYRIMIDINE AND 2'-FLUOROPURINE NUCLEOSIDES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, U.S. DEPARTMENT OF COMMERCE (US) 1992-02-06 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 (1 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-20220273689-A1 POTENTIATION OF ANTIVIRAL NUCLEOBASES AS RNA VIRUS THERAPY NSUN3, NSUN2, RNMT MAP3K5 3594/4885PDPK1 2989/4885GDA 161/4885

“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.