SCHEMBL341706

SCHEMBL341706

Nc1nc(Cl)c2cn[nH]c2n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 5/20 0.47
ADORA1 P30542 4/20 0.47
CDK2 P24941 1/20 0.43
XDH P47989 2/20 0.42
RET P07949 1/20 0.42
PI4KA P42356 1/20 0.42
LRRK2 Q5S007 1/20 0.42
PI4K2B Q8TCG2 1/20 0.42
PI4K2A Q9BTU6 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
DHFR P00374 1/20 0.40
DPP4 P27487 1/20 0.39
CHUK O15111 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
RAB9A P51151 1/20 0.36
BLM P54132 1/20 0.36

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
SCHEMBL14570604 0.80 ADORA2A (0.47) ADORA2AADORA1CDK2XDHRET
SCHEMBL29487078 0.79 XDH (0.55) ADORA2AADORA1CDK2XDHRET
SCHEMBL1014920 0.79 XDH (0.55) ADORA2AADORA1CDK2XDHRET
SCHEMBL53863 0.79 PLK4 (0.47) ADORA2AXDHRETPI4KALRRK2
Benzene SCHEMBL25427466 0.76 RET (0.52) ADORA2AADORA1CDK2XDHRET
SCHEMBL888387 0.76 ADORA2A (0.47) ADORA2AADORA1CDK2XDHRET
SCHEMBL2629520 0.76 ADORA2A (0.47) ADORA2AADORA1CDK2XDHRET
SCHEMBL19891462 0.76 ADORA2A (0.47) ADORA2AADORA1CDK2XDHRET
SCHEMBL12398424 0.76 PLK4 (0.36) XDHRETPI4KALRRK2PI4K2B
SCHEMBL31439112 0.76 NOS1 (0.37) CDK2XDHRETPI4KALRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12606564-B2 Adenosine receptor antagonist compounds ILDONG PHARMACEUTICAL CO., LTD. (KR) 2026-04-21 US disclosed
CN-116425756-B Adenosine receptor antagonist compounds and uses thereof 日东制药株式会社 2025-05-13 CN disclosed
WO-2025076284-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME DELPHIA THERAPEUTICS, INC. (US) 2025-04-10 WO disclosed
US-20250084089-A1 Unique and Selective Targeting of CDK Activity in Aggressive Carcinomas UNIVERSITY OF WINDSOR (CA) 2025-03-13 US disclosed
WO-2024242530-A1 COMPOUND FOR NEUROPROTECTION, OR TREATING DISEASES RELATED TO ALPHA-SYNUCLEIN AND/OR NEURO-INFLAMMATION YUNOVIA CO., LTD. (KR) 2024-11-28 WO disclosed
CN-114829363-B Adenosine receptor antagonist compounds 日东制药株式会社 2024-10-01 CN disclosed
US-20240041888-A1 PREVENTION AND/OR TREATMENT OF CNS DISORDERS ILDONG PHARMACEUTICAL CO., LTD. (KR) 2024-02-08 US disclosed
US-11806350-B2 Prevention and/or treatment of CNS disorders ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-07 US disclosed
US-11806350-B2 Prevention and/or treatment of CNS disorders ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-07 US disclosed
US-11806350-B2 Prevention and/or treatment of CNS disorders ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-07 US disclosed
US-20060014943-A1 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. (US) 2006-01-19 US disclosed
US-6962991-B2 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. (US) 2005-11-08 US disclosed
US-20050119282-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors CONFORMA THERAPEUTICS CORPORATION 2005-06-02 US disclosed
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists SCHERING CORPORATION 2004-11-04 US disclosed
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists SCHERING CORPORATION 2004-11-04 US disclosed
US-20040191824-A1 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. 2004-09-30 US disclosed
US-20040116447-A1 Pyrazolo[3,4-d]pyrimidine derivatives and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED (GB) 2004-06-17 US disclosed
EP-1427743-A2 PROCESS FOR THE SYNTHESIS OF PYRAZOLOPYRIMIDINES Epoch Biosciences, Inc. (US) 2004-06-16 EP disclosed
US-20030078413-A1 Process for the synthesis of pyrazolopyrimidines EPOCH BIOSCIENCES, INC. 2003-04-24 US disclosed
WO-2003022859-A2 PROCESS FOR THE SYNTHESIS OF PYRAZOLOPYRIMIDINES EPOCH BIOSCIENCES, INC. (US) 2003-03-20 WO 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 (8 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-20250084089-A1 Unique and Selective Targeting of CDK Activity in Aggressive Carcinomas CDK4, CDK3, CDKN1A ADORA2A 3543/4885ADORA1 4521/4885CDK2 4/4885
US-20050119282-A1 Pyrazolopyrimidines and related analogs as HSP90-inhibitors HSP90AB2P, HSP90AB1, HSP90AA1 ADORA2A 4548/4885ADORA1 4784/4885CDK2 328/4885
US-20030078413-A1 Process for the synthesis of pyrazolopyrimidines DPYD, PNP, UMPS ADORA2A 734/4885ADORA1 1524/4885CDK2 553/4885
US-20060014943-A1 Process for the synthesis of pyrazolopyrimidines DPYD, PNP, UMPS ADORA2A 734/4885ADORA1 1524/4885CDK2 553/4885
US-20040220194-A1 2-Alkynyl-and 2-alkenyl-pyrazolo-[4,3-e]-1,2,4-triazolo-[1,5-c]-pyrimidine adenosine A2a receptor antagonists ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA1 3/4885CDK2 1109/4885
US-20240041888-A1 PREVENTION AND/OR TREATMENT OF CNS DISORDERS ADORA2A, ADORA1, ADORA2B ADORA2A 1/4885ADORA1 2/4885CDK2 1323/4885
US-12606564-B2 Adenosine receptor antagonist compounds ADORA2A, ADORA1, ADORA2B ADORA2A 1/4885ADORA1 2/4885CDK2 1768/4885
US-11806350-B2 Prevention and/or treatment of CNS disorders ADORA2A, ADORA1, ADORA2B ADORA2A 1/4885ADORA1 2/4885CDK2 1323/4885

“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.