SCHEMBL6153979

SCHEMBL6153979

CCOC(=O)C(CCn1cnc2c(Cl)nc(N)nc21)(C(=O)OCC)C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 17/20 0.50
HSP90AA1 P07900 16/20 0.50
HSP90B1 P14625 1/20 0.46
TRAP1 Q12931 1/20 0.46
HDAC6 Q9UBN7 2/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
CYP2C19 P33261 1/20 0.44

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
SCHEMBL6770698 0.95 HSP90AB1 (0.48) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL7813344 0.88 CYP2C19 (0.46) HSP90AB1HSP90AA1HDAC1CYP2C19
SCHEMBL14227939 0.83 HSP90AB1 (0.43) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL28439303 0.82 ADORA2A (0.37) HSP90AB1HSP90AA1
SCHEMBL6322265 0.81 CYP2C19 (0.47) HSP90AB1HSP90AA1CYP2C19
SCHEMBL7816738 0.81 KDM4E (0.56) HSP90AB1HSP90AA1HDAC6CYP2C19
SCHEMBL13645718 0.81 HSP90AB1 (0.51) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL8649570 0.80 HSP90AB1 (0.55) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL9116660 0.80 HSP90AB1 (0.46) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6
SCHEMBL10917478 0.80 HSP90AB1 (0.50) HSP90AB1HSP90AA1HSP90B1TRAP1HDAC6

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110713490-A Preparation method of penciclovir 浙江医药股份有限公司新昌制药厂 2020-01-21 CN claimed
CN-112979653-A Method for synthesizing famciclovir by using microchannel reactor 上药康丽(常州)药业有限公司 2021-06-18 CN disclosed
CN-108314685-B Preparation method of 2-amino-6-chloro-9- (4-acetoxyl-3-acetoxymethyl butyl) purine 上药康丽(常州)药业有限公司 2020-08-25 CN disclosed
CN-108484605-B Preparation method of 2-amino-6-chloro-9- (4-acetoxyl-3-acetoxymethyl butyl) purine 上药康丽(常州)药业有限公司 2020-08-21 CN disclosed
CN-110713490-A Preparation method of penciclovir 浙江医药股份有限公司新昌制药厂 2020-01-21 CN disclosed
CN-101195622-A Process for the preparation of famciclovir FANGXIA ENTPR INF CONSULT CO (CN) 2008-06-11 CN disclosed
US-7355043-B2 Preparation of purines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2008-04-08 US disclosed
EP-1068209-B1 PROCESS FOR THE PRODUCTION OF PURINE DERIVATIVES AND INTERMEDIATES THEREFOR NOVARTIS INT PHARM LTD (BM) 2005-09-14 EP disclosed
EP-1068210-B1 PROCESS FOR THE PRODUCTION OF PURINE DERIVATIVES NOVARTIS INT PHARM LTD (BM) 2004-06-02 EP disclosed
US-20030130512-A1 Process for the production of purine derivatives and intermediates therefor DPT LABORATORIES, LTD. 2003-07-10 US disclosed
US-6437125-B1 REARRANGEMENT OF N-7 ALKYL GROUP TO THE N-9; PALLADIUM CATALYST AND A (DIPHENYLPHOSPHINO)ALKANE; PENCICLOVIR AND FAMCICLOVIR NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2002-08-20 US disclosed
EP-1068209-A1 PROCESS FOR THE PRODUCTION OF PURINE DERIVATIVES AND INTERMEDIATES THEREFOR SMITHKLINE BEECHAM PLC (GB) 2001-01-17 EP disclosed
EP-1068210-A2 PROCESS FOR THE PRODUCTION OF PURINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 2001-01-17 EP disclosed
WO-1999051604-A2 PROCESS FOR THE PRODUCTION OF PURINE DERIVATIVES SMITHKLINE BEECHAM PLC (GB) 1999-10-14 WO disclosed
WO-1999051603-A1 PROCESS FOR THE PRODUCTION OF PURINE DERIVATIVES AND INTERMEDIATES THEREFOR SMITHKLINE BEECHAM PLC (GB) 1999-10-14 WO disclosed
EP-0302644-B1 Purine compounds and their preparation BEECHAM GROUP PLC (GB) 1997-01-29 EP disclosed
US-5175288-A Process for preparing purine derivatives and intermediates thereof BEECHAM GROUP P.L.C. (GB) 1992-12-29 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 (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-20030130512-A1 Process for the production of purine derivatives and intermediates therefor TYMP, DPYD, PNP HSP90AB1 4738/4885HSP90AA1 4716/4885HSP90B1 4209/4885

“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.