SCHEMBL215724

SCHEMBL215724

Nc1c2[nH]cnc2nc[n+]1[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 2/20 0.46
▸ PI4K2B Q8TCG2 2/20 0.46
▸ PI4K2A Q9BTU6 2/20 0.46
▸ PI4KB Q9UBF8 2/20 0.46
▸ LRRK2 Q5S007 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ DRD3 P35462 1/20 0.46
▸ XDH P47989 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.42
▸ PDPK1 O15530 3/20 0.40
▸ GDA Q9Y2T3 1/20 0.40
▸ CDK2 P24941 2/20 0.38
▸ DPP4 P27487 1/20 0.38
▸ PNP P00491 1/20 0.37
▸ HRH4 Q9H3N8 2/20 0.36
▸ G6PD P11413 1/20 0.36
▸ HTT P42858 2/20 0.36
▸ TP53 P04637 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ MAP3K5 Q99683 1/20 0.35

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
SCHEMBL864311 0.77 ALDH1A1 (0.42) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL17372398 0.77 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL19529689 0.77 LMNA (0.46) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL17176923 0.69 PNP (0.50) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL215723 0.69 PNP (0.30) PNP
Adenine SCHEMBL29355156 0.63 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL1331751 0.63 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL29466915 0.63 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL8111 0.63 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2
Adenine SCHEMBL3414606 0.63 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8618074-B2 GPCR enhanced neuroprotection to treat brain injury BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-12-31 — — US claimed
US-20100216735-A1 GPCR ENHANCED NEUROPROTECTION TO TREAT BRAIN INJURY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2010-08-26 — — US claimed
WO-2008113072-A2 GPCR ENHANCED NEUROPROTECTION TO TREAT BRAIN INJURY BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-09-18 — — WO claimed
EP-1959968-A2 MODULATION OF THE P2Y2 RECEPTOR PATHWAY P2-Science APS (DK) 2008-08-27 — — EP claimed
EP-1545407-A4 VAGINAL HEALTH PRODUCTS KIMBERLY CLARK CO (US) 2008-05-07 — — EP claimed
WO-2007065437-A2 MODULATION OF THE P2Y2 RECEPTOR PATHWAY P2-SCIENCE APS (DK) 2007-06-14 — — WO claimed
US-6977246-B2 Certain dinucleotides and their use as modulators of mucociliary clearance and ciliary beat frequency INSPIRE PHARMACEUTICALS, INC. (US) 2005-12-20 — — US claimed
CN-1678261-A Vaginal health product KIMBERLY CLARK CO (US) 2005-10-05 — — CN claimed
EP-1545407-A2 VAGINAL HEALTH PRODUCTS Kimberly-Clark Worldwide, Inc. (US) 2005-06-29 — — EP claimed
US-20040063787-A1 Vaginal health products KIMBERLY-CLARK WORLDWIDE, INC. 2004-04-01 — — US claimed
US-5763447-A Method of preventing or treating pneumonia in immobilized patients with uridine triphosphates and related compounds INSPIRE PHARMACEUTICALS (US) 1998-06-09 — — US claimed
WO-1998019685-A1 METHOD OF TREATING BRONCHITIS WITH URIDINE TRIPHOSPHATES AND RELATED COMPOUNDS INSPIRE PHARMACEUTICALS, INC. (US) 1998-05-14 — — WO claimed
WO-1998015835-A1 METHOD OF EARLY LUNG CANCER DETECTION VIA SPUTUM INDUCTION AND ANALYSIS OF SPUTUM TO DETECT CANCER ASSOCIATED SUBSTANCES INSPIRE PHARMACEUTICALS, INC. (US) 1998-04-16 — — WO claimed
WO-1997035591-A9 METHOD OF TREATING CILIARY DYSKINESIA WITH URIDINE TRIPHOSPHATES AND RELATED COMPOUNDS — 1998-02-19 — — WO claimed
WO-1998003177-A1 METHOD OF TREATING SINUSITIS WITH URIDINE TRIPHOSPHATES AND RELATED COMPOUNDS INSPIRE PHARMACEUTICALS, INC. (US) 1998-01-29 — — WO claimed
WO-1998003182-A2 USE OF URIDINE TRIPHOSPHATES AND RELATED COMPOUNDS FOR THE PREVENTION AND TREATMENT OF PNEUMONIA IN IMMOBILIZED PATIENTS INSPIRE PHARMACEUTICALS, INC. (US) 1998-01-29 — — WO claimed
WO-1997035591-A2 METHOD OF TREATING CILIARY DYSKINESIA WITH URIDINE TRIPHOSPHATES AND RELATED COMPOUNDS INSPIRE PHARMACEUTICALS, INC. (US) 1997-10-02 — — WO claimed
WO-1997029756-A1 METHOD OF TREATING OTITIS MEDIA WITH URIDINE TRIPHOSPHATES AND RELATED COMPOUNDS INSPIRE PHARMACEUTICALS, INC. (US) 1997-08-21 — — WO claimed
EP-0540686-B1 2'-FLUOROFURANOSYL DERIVATIVES AND NOVEL METHOD OF PREPARING 2'-FLUOROPYRIMIDINE AND 2'-FLUOROPURINE NUCLEOSIDES US COMMERCE (US) 1995-08-30 — — EP claimed
WO-1992001700-A1 2'-FLUOROFURANOSYL DERIVATIVES AND NOVEL METHOD OF PREPARING 2'-FLUOROPYRIMIDINE AND 2'-FLUOROPURINE NUCLEOSIDES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, U.S. DEPARTMENT OF COMMERCE (US) 1992-02-06 — — WO claimed

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-20100216735-A1 GPCR ENHANCED NEUROPROTECTION TO TREAT BRAIN INJURY P2RY1, P2RY2, P2RY11 PI4KA 1241/4885PI4K2B 1555/4885PI4K2A 1282/4885
US-20040063787-A1 Vaginal health products MUC1, PGF, AQP3 PI4KA 3616/4885PI4K2B 3534/4885PI4K2A 3448/4885

“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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