SCHEMBL710318

SCHEMBL710318

COc1ccc(-c2n[nH]c(=O)c3ccccc23)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
PDE4A P27815 1/20 0.67
PDE4B Q07343 1/20 0.67
PDE4C Q08493 1/20 0.67
PDE4D Q08499 1/20 0.67
MAPK1 P28482 1/20 0.65
ROCK1 Q13464 7/20 0.59
ROCK2 O75116 3/20 0.58
KDM4E B2RXH2 3/20 0.57
ALDH1A1 P00352 2/20 0.57
NPC1 O15118 1/20 0.57
NCOA1 Q15788 1/20 0.57
NCOA3 Q9Y6Q9 1/20 0.57
GAA P10253 2/20 0.57
MAPT P10636 2/20 0.57
CDK4 P11802 2/20 0.56
CCND1 P24385 2/20 0.56
CCNE2 O96020 1/20 0.56
CCNE1 P24864 1/20 0.56

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
SCHEMBL30719652 1.00 ATM (0.67) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL1934226 0.86 PDE4A (0.52) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL4124300 0.86 ENPP1 (0.66) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL4841775 0.84 GSK3A (0.62) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL4843618 0.83 GSK3A (0.65) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL6591973 0.83 GSK3A (0.65) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL2887372 0.83 KDM4E (0.54) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL2885503 0.82 CCNE2 (0.56) ATMNPSR1PDE4APDE4BPDE4C
SCHEMBL4837386 0.82 ENPP1 (0.56) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL4837888 0.82 GSK3A (0.53) PDE4APDE4BPDE4CPDE4DMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117659025-A TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2024-03-08 CN disclosed
CN-117586108-A TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2024-02-23 CN disclosed
CN-117586191-A TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2024-02-23 CN disclosed
CN-111542515-B TOLL-like receptor 8 (TLR 8) specific antagonists, methods of making and uses thereof 科罗拉多州立大学董事会法人团体 2023-12-05 CN disclosed
US-20230132035-A1 Toll-Like Receptor 8 (TLR8)-Specific Antagonists and Methods of Making and Uses Thereof UNIV COLORADO REGENTS (US) 2023-04-27 US disclosed
US-11466010-B2 Toll-like receptor 8 (TLR8) specific antagonists and methods of making and uses thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2022-10-11 US disclosed
US-20210179621-A1 Toll-Like Receptor 8 (TLR8) Specific Antagonists and Methods of Making and Uses Thereof THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2021-06-17 US disclosed
CN-111542515-A TOLL-like receptor 8(TLR8) specific antagonist and preparation method and application thereof 科罗拉多州立大学董事会法人团体 2020-08-14 CN disclosed
US-8629143-B2 Potassium channel modulators ABBVIE INC. (US) 2014-01-14 US disclosed
US-8124584-B2 Macrocyclic hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2012-02-28 US disclosed
US-20070167453-A1 Nitrogenous fused heteroaromatic ring derivative MSD K.K. (JP) 2007-07-19 US disclosed
EP-1590442-A4 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARM INC (US) 2007-07-18 EP disclosed
US-7220858-B2 Synthesis of hydrazine and chlorinated derivatives of bicyclic pyridazines BARBEAU PHARMA, INC. (US) 2007-05-22 US disclosed
EP-1719756-A1 NITROGENOUS FUSED HETEROAROMATIC RING DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-08 EP disclosed
EP-1590442-A3 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS Enanta Pharmaceuticals, Inc. (US) 2005-11-03 EP disclosed
EP-1590442-A2 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS Enanta Pharmaceuticals, Inc. (US) 2005-11-02 EP disclosed
US-20050153877-A1 Macrocyclic hepatitis C serine protease inhibitors ENANTA PHARMACEUTICALS, INC. 2005-07-14 US disclosed
US-20050137397-A1 Synthesis of hydrazine derivatives of pyridazine BIONICHE TEORANTA 2005-06-23 US disclosed
US-20040180815-A1 Pyridazinonyl macrocyclic hepatitis C serine protease inhibitors NAKAJIMA SUANNE (US) 2004-09-16 US disclosed
WO-2004072243-A2 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2004-08-26 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 (7 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-20050153877-A1 Macrocyclic hepatitis C serine protease inhibitors PRSS1, SPINT2, TMPRSS4 ATM 4056/4885NPSR1 2012/4885PDE4A 876/4885
US-20040180815-A1 Pyridazinonyl macrocyclic hepatitis C serine protease inhibitors PRSS1, SPINT2, TMPRSS4 ATM 4253/4885NPSR1 2424/4885PDE4A 667/4885
US-20230132035-A1 Toll-Like Receptor 8 (TLR8)-Specific Antagonists and Methods of Making and Uses Thereof TLR8, TLR3, TLR9 ATM 3143/4885NPSR1 760/4885PDE4A 843/4885
US-20050137397-A1 Synthesis of hydrazine derivatives of pyridazine DHPS, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HPD ATM 3966/4885NPSR1 1845/4885PDE4A 1711/4885
US-20070167453-A1 Nitrogenous fused heteroaromatic ring derivative HRH3, HRH2, HRH4 ATM 3753/4885NPSR1 23/4885PDE4A 4780/4885
US-20210179621-A1 Toll-Like Receptor 8 (TLR8) Specific Antagonists and Methods of Making and Uses Thereof TLR8, TLR3, TLR9 ATM 3168/4885NPSR1 783/4885PDE4A 905/4885
US-11466010-B2 Toll-like receptor 8 (TLR8) specific antagonists and methods of making and uses thereof TLR8, TLR3, TLR9 ATM 3168/4885NPSR1 783/4885PDE4A 905/4885

“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.