SCHEMBL807452

SCHEMBL807452

Nc1nc(N)c2cccn2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.50
JAK2 O60674 6/20 0.45
NUDT1 P36639 1/20 0.42
EGFR P00533 1/20 0.42
PIK3CA P42336 3/20 0.38
PIK3CD O00329 2/20 0.35
PAK4 O96013 1/20 0.35
CSF1R P07333 1/20 0.35
RET P07949 1/20 0.35
GRK5 P34947 1/20 0.35
MAPK8 P45983 1/20 0.35
CSNK1A1 P48729 1/20 0.35
ACVR1 Q04771 1/20 0.35
PTK2 Q05397 1/20 0.35
TYRO3 Q06418 1/20 0.35
MAP4K2 Q12851 1/20 0.35
DYRK1A Q13627 1/20 0.35
IKBKE Q14164 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
DYRK1B Q9Y463 1/20 0.35

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
SCHEMBL30989127 0.80 MAP4K4 (0.47) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL12314541 0.80 MAP4K4 (0.47) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL10001046 0.80 JAK2 (0.42) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL29350296 0.80 MAP4K4 (0.47) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL12462946 0.80 PTPN1 (0.46) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL12395227 0.80 NUDT1 (0.47) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL807453 0.80 MAP4K4 (0.47) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL5080208 0.80 MAP4K4 (0.47) MAP4K4JAK2EGFRPIK3CAPIK3CD
SCHEMBL17174630 0.76 JAK2 (0.43) MAP4K4JAK2NUDT1EGFRPIK3CA
SCHEMBL12395115 0.76 PDE5A (0.44) MAP4K4JAK2NUDT1EGFRPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11472826-B2 Acyclic antivirals JANSSEN PHARMACEUTICA NV (BE) 2022-10-18 US disclosed
US-20200392169-A1 ACYCLIC ANTIVIRALS JANSSEN BIOPHARMA, LLC 2020-12-17 US disclosed
US-10745427-B2 Acyclic antivirals Janssen Biopharma, Inc. (US) 2020-08-18 US disclosed
US-10377761-B2 Pyrrolo[1,2-f][1,2,4]triazines useful for treating respiratory syncitial virus infections GILEAD SCIENCES, INC. (US) 2019-08-13 US disclosed
EP-3068405-B1 PYRROLO [1,2,F][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES INC (US) 2019-05-01 EP disclosed
US-20190055273-A1 ACYCLIC ANTIVIRALS Janssen Pharmaceuticals, Inc. 2019-02-21 US disclosed
US-20190055253-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES, INC. 2019-02-21 US disclosed
US-RE46762-E1 1′-substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC (US) 2018-03-27 US disclosed
US-RE46762-E1 1′-substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC (US) 2018-03-27 US disclosed
US-20180016280-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS GILEAD SCIENCES, INC. 2018-01-18 US disclosed
US-8318682-B2 1′substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-11-27 US disclosed
US-8318682-B2 1′substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-11-27 US disclosed
EP-2049542-B1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2012-09-19 EP disclosed
US-20120107274-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-05-03 US disclosed
US-20120107274-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-05-03 US disclosed
WO-2012037038-A1 2' -FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-03-22 WO disclosed
US-8008264-B2 1′-substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-08-30 US disclosed
US-8008264-B2 1′-substituted carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-08-30 US disclosed
US-20100021425-A1 1'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-01-28 US disclosed
US-20100021425-A1 1'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-01-28 US disclosed

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

For each of this compound's patents that has machine-readable text (9 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-11472826-B2 Acyclic antivirals PNP, DUT, TYMP MAP4K4 2667/4885JAK2 4321/4885NUDT1 4/4885
US-20120107274-A1 2'-FLUORO SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, NUDT1, SLC29A2 MAP4K4 1289/4885JAK2 2664/4885NUDT1 2/4885
US-20180016280-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS SYNJ1, SARS1, SYNJ2 MAP4K4 2212/4885JAK2 1131/4885NUDT1 3085/4885
US-10377761-B2 Pyrrolo[1,2-f][1,2,4]triazines useful for treating respiratory syncitial virus infections SYNJ1, SARS1, SYNJ2 MAP4K4 2212/4885JAK2 1131/4885NUDT1 3085/4885
US-20100021425-A1 1'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, MTAP, SLC29A1 MAP4K4 803/4885JAK2 1116/4885NUDT1 34/4885
US-20190055273-A1 ACYCLIC ANTIVIRALS PNP, TYMP, DUT MAP4K4 2922/4885JAK2 3878/4885NUDT1 4/4885
US-20190055253-A1 PYRROLO[1,2-f][1,2,4]TRIAZINES USEFUL FOR TREATING RESPIRATORY SYNCITIAL VIRUS INFECTIONS SYNJ1, SARS1, SYNJ2 MAP4K4 2212/4885JAK2 1131/4885NUDT1 3085/4885
US-20200392169-A1 ACYCLIC ANTIVIRALS PNP, DUT, TYMP MAP4K4 2667/4885JAK2 4321/4885NUDT1 4/4885
US-10745427-B2 Acyclic antivirals PNP, DUT, TYMP MAP4K4 2667/4885JAK2 4321/4885NUDT1 4/4885

“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.