SCHEMBL458772

SCHEMBL458772

NC(=O)c1csc(-n2cnc3c(N)ncnc32)n1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 10/20 0.45
▸ PI4K2B Q8TCG2 10/20 0.45
▸ PI4K2A Q9BTU6 10/20 0.45
▸ PI4KB Q9UBF8 10/20 0.45
▸ EGFR P00533 2/20 0.45
▸ IMPDH2 P12268 6/20 0.42
▸ IMPDH1 P20839 6/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ ADORA2A P29274 1/20 0.40
▸ ADORA1 P30542 1/20 0.40

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
SCHEMBL4449476 0.77 PI4KA (0.45) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL3878154 0.73 XDH (0.49) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL4439065 0.71 PI4KA (0.53) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL17802561 0.70 CFTR (0.66) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL22583653 0.69 FGFR1 (0.49) —
SCHEMBL2346678 0.67 GSK3B (0.67) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL17354760 0.66 PI4KA (0.50) PI4KAPI4K2BPI4K2API4KBEGFR
Hydrochloric Acid SCHEMBL29003046 0.65 GSK3B (0.65) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL17354662 0.65 ADORA2A (0.48) PI4KAPI4K2BPI4K2API4KBEGFR
SCHEMBL27599134 0.65 GSK3B (0.69) PI4KAPI4K2BPI4K2API4KBEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0707479-A4 METHOD FOR THE TREATMENT OF NEOPLASTIC DISEASE UTILIZING TIAZOFURIN AND RIBAVIRIN INDIANA UNIVERSITY FOUNDATION (US) 1998-04-15 — — EP claimed
EP-0707479-A1 METHOD FOR THE TREATMENT OF NEOPLASTIC DISEASE UTILIZING TIAZOFURIN AND RIBAVIRIN INDIANA UNIVERSITY FOUNDATION (US) 1996-04-24 — — EP claimed
WO-1994026281-A1 METHOD FOR THE TREATMENT OF NEOPLASTIC DISEASE UTILIZING TIAZOFURIN AND RIBAVIRIN INDIANA UNIVERSITY FOUNDATION (US) 1994-11-24 — — WO claimed
WO-2024081890-A2 METHODS OF ASSESSING METABOLIC FLUX THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-04-18 — — WO disclosed
WO-2023225466-A2 INHIBITING PURINE BIOSYNTHESIS TO INCREASE FAVIPIRAVIR POTENCY AGAINST RNA VIRUS INFECTIONS VIRIOM, INC. (US) 2023-11-23 — — WO disclosed
US-20220202803-A1 COMBINATION THERAPIES INCLUDING INHIBITORS OF DIHYDROOROTATE DEHYDROGENASE CLEAR CREEK BIO INC (US) 2022-06-30 — — US disclosed
US-20220105120-A1 COMPOSITIONS AND METHODS FOR INHIBITING INOSINE MONOPHOSPHATE DEHYDROGENASE CLEAR CREEK BIO INC (US) 2022-04-07 — — US disclosed
US-20210115493-A1 METHODS FOR DETERMINING A DRUG DOSING REGIMEN Clear Creek Bio, Inc. 2021-04-22 — — US disclosed
US-20210113548-A1 METHODS FOR DETERMINING A DRUG DOSING REGIMEN Clear Creek Bio, Inc. 2021-04-22 — — US disclosed
WO-2020219423-A1 COMBINATION THERAPIES INCLUDING INHIBITORS OF DIHYDROOROTATE DEHYDROGENASE Clear Creek Bio, Inc. (US) 2020-10-29 — — WO disclosed
WO-2020163412-A1 COMPOSITIONS AND METHODS FOR INHIBITING INOSINE MONOPHOSPHATE DEHYDROGENASE Clear Creek Bio, Inc. (US) 2020-08-13 — — WO disclosed
EP-0707479-A4 METHOD FOR THE TREATMENT OF NEOPLASTIC DISEASE UTILIZING TIAZOFURIN AND RIBAVIRIN INDIANA UNIVERSITY FOUNDATION (US) 1998-04-15 — — EP disclosed
US-5658890-A INHIBITORS OF INOSINE MONOPHOSPHATE DEHYDROGENASE SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1997-08-19 — — US disclosed
EP-0707479-A1 METHOD FOR THE TREATMENT OF NEOPLASTIC DISEASE UTILIZING TIAZOFURIN AND RIBAVIRIN INDIANA UNIVERSITY FOUNDATION (US) 1996-04-24 — — EP disclosed
US-5405837-A Method for the treatment of neoplastic disease utilizing tiazofurin and ribavirin INDIANA UNIVERSITY FOUNDATION (US) 1995-04-11 — — US disclosed
WO-1995008994-A1 ANTINEOPLASTIC COMBINATION OF TAXOL AND TIAZOFURIN INDIANA UNIVERSITY FOUNDATION (US) 1995-04-06 — — WO disclosed
WO-1994026281-A1 METHOD FOR THE TREATMENT OF NEOPLASTIC DISEASE UTILIZING TIAZOFURIN AND RIBAVIRIN INDIANA UNIVERSITY FOUNDATION (US) 1994-11-24 — — WO disclosed
US-5358855-A Inosinic acid dehydrogenase assay THE MEDICAL COLLEGE OF PENNSYLVANIA (US) 1994-10-25 — — US disclosed
WO-1993023558-A1 INOSINIC ACID DEHYDROGENASE ASSAY THE MEDICAL COLLEGE OF PENNSYLVANIA (US) 1993-11-25 — — WO disclosed
US-4446315-A ANTITUMOR AGENTS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1984-05-01 — — 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 (4 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-20210115493-A1 METHODS FOR DETERMINING A DRUG DOSING REGIMEN CYP3A5, CYP2D6, CYP3A4 PI4KA 4166/4885PI4K2B 4578/4885PI4K2A 4473/4885
US-20220105120-A1 COMPOSITIONS AND METHODS FOR INHIBITING INOSINE MONOPHOSPHATE DEHYDROGENASE IMPDH1, IMPDH2, ITPA PI4KA 1868/4885PI4K2B 2419/4885PI4K2A 2365/4885
US-20210113548-A1 METHODS FOR DETERMINING A DRUG DOSING REGIMEN CYP3A5, CYP2D6, CYP3A4 PI4KA 4166/4885PI4K2B 4578/4885PI4K2A 4473/4885
US-20220202803-A1 COMBINATION THERAPIES INCLUDING INHIBITORS OF DIHYDROOROTATE DEHYDROGENASE DHODH, DPYD, DLD PI4KA 2579/4885PI4K2B 3152/4885PI4K2A 3115/4885

“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.

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