SCHEMBL7151977

SCHEMBL7151977

C[C@@H]1CC[C@H](n2cnc3c(N)ncnc32)O1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 4/20 0.61
▸ PI4K2B Q8TCG2 4/20 0.61
▸ PI4K2A Q9BTU6 4/20 0.61
▸ PI4KB Q9UBF8 4/20 0.61
▸ NFKB1 P19838 2/20 0.61
▸ BLM P54132 2/20 0.61
▸ TP53 P04637 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ HSD17B10 Q99714 1/20 0.61
▸ MEN1 O00255 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ APEX1 P27695 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ ADCY1 Q08828 1/20 0.61
▸ ADORA2A P29274 4/20 0.60
▸ ADORA3 P0DMS8 2/20 0.57
▸ ADORA1 P30542 2/20 0.57
▸ ADORA2B P29275 1/20 0.57
▸ ADA P00813 1/20 0.55

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
SCHEMBL8175179 1.00 PI4KA (0.61) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL20794210 1.00 PI4KA (0.61) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL24499895 1.00 PI4KA (0.61) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL12832016 1.00 PI4KA (0.61) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL13690449 0.83 PI4KA (0.61) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL22820040 0.83 CYP2C19 (0.42) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL13939562 0.83 PI4KA (0.57) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL7162148 0.83 PI4KA (0.57) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL19242531 0.81 ADORA3 (0.42) PI4KAPI4K2BPI4K2API4KBNFKB1
SCHEMBL19941993 0.81 PI4KA (0.59) PI4KAPI4K2BPI4K2API4KBNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210238216-A1 PHARMACEUTICAL AGENTS, COMPOSITIONS, AND METHODS RELATING THERETO WILMINGTON TRUST, NATIONAL ASSOCIATION, AS ADMINISTRATIVE AGENT 2021-08-05 — — US disclosed
US-8110676-B2 Prodrugs activated by RNA-dependent DNA-polymerases PROTERA S.R.L. (IT) 2012-02-07 — — US disclosed
EP-2287613-A2 Detection, monitoring and treatment of cancer THE OPEN UNIVERSITY (GB) 2011-02-23 — — EP disclosed
US-20080300215-A1 Prodrugs Activated by Rna-Dependent Dna-Polymerases PROTERA S.R.L. (IT) 2008-12-04 — — US disclosed
EP-1806585-A1 Detection, monitoring and treatment of cancer THE OPEN UNIVERSITY (GB) 2007-07-11 — — EP disclosed
US-6562514-B1 Stabilized vanadium electrolyte solutions for all-vanadium redox cells and batteries PINNACLE VRB LIMITED (AU) 2003-05-13 — — US disclosed
US-6468688-B2 CHARGING, DISCHARGING EFFICIENCY; VANADIUM ELECTROLYTE PINNACLE VRB LIMITED (AU) 2002-10-22 — — US disclosed
US-20010028977-A1 Charging, discharging efficiency; vanadium electrolyte JD HOLDING INC. (KY) 2001-10-11 — — US disclosed
US-6143443-A ALL-VANADIUM REDOX BATTERY, COMPRISING THE STABILIZED ELECTROLYTE PINNACLE ARB LIMITED (AU) 2000-11-07 — — US disclosed
EP-0829104-A1 HIGH ENERGY DENSITY VANADIUM ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND ALL-VANADIUM REDOX CELLS AND BATTERIES CONTAINING HIGH ENERGY VANADIUM ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1998-03-18 — — EP disclosed
EP-0729648-A1 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1996-09-04 — — EP disclosed
WO-1995012219-A1 STABILISED ELECTROLYTE SOLUTIONS, METHODS OF PREPARATION THEREOF AND REDOX CELLS AND BATTERIES CONTAINING STABILISED ELECTROLYTE SOLUTIONS UNISEARCH LIMITED (AU) 1995-05-04 — — WO disclosed
EP-0216511-B1 Inhibition of in vitro infectivity and cytopathic effect of HTLV-III/LAV by 2'3'-dideoxycytidine US COMMERCE (US) 1993-10-27 — — EP disclosed
EP-0216510-B1 Inhibition of in vitro infectivity and cytopathic effect of HTLV-III/LAV by 2'3'-dideoxyinosine, 2'3'-dideoxyguanosine, or 2'3'-dideoxyadenosine US COMMERCE (US) 1993-10-27 — — EP disclosed
US-5254539-A Method of treating HIV with 2',3'-dideoxyinosine U.S. GOVERNMENT, DEPT. OF HEALTH AND HUMAN SERVICES, C/O NATIONAL INSTITUTES OF HEALTH (US) 1993-10-19 — — US disclosed
EP-0371366-A1 Antiviral agents SYNTEX (U.S.A.) INC. (US) 1990-06-06 — — EP disclosed
US-4861759-A Antiviral compositions and methods THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1989-08-29 — — US disclosed
US-4704357-A TESTING DRUGS FOR EFFICARY AGAINST AIDS VIRUS UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1987-11-03 — — US disclosed
EP-0216510-A2 Inhibition of in vitro infectivity and cytopathic effect of HTLV-III/LAV by 2'3'-dideoxyinosine, 2'3'-dideoxyguanosine, or 2'3'-dideoxyadenosine THE UNITED STATES OF AMERICA as represented by the Secretary United States Department of Commerce (US) 1987-04-01 — — EP disclosed
EP-0216511-A2 Inhibition of in vitro infectivity and cytopathic effect of HTLV-III/LAV by 2'3'-dideoxycytidine THE UNITED STATES OF AMERICA as represented by the Secretary United States Department of Commerce (US) 1987-04-01 — — EP 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 (2 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-20210238216-A1 PHARMACEUTICAL AGENTS, COMPOSITIONS, AND METHODS RELATING THERETO PCSK9, PCSK7, PDE3A PI4KA 3824/4885PI4K2B 3836/4885PI4K2A 3704/4885
US-20080300215-A1 Prodrugs Activated by Rna-Dependent Dna-Polymerases TERT, POLRMT, POLI PI4KA 975/4885PI4K2B 2197/4885PI4K2A 1776/4885

“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.

Send feedback