SCHEMBL2291671

SCHEMBL2291671

CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@H]2n1cnc2c(O)ncnc21

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.80
PI4K2B Q8TCG2 2/20 0.80
PI4K2A Q9BTU6 2/20 0.80
PI4KB Q9UBF8 2/20 0.80
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
RXFP1 Q9HBX9 1/20 0.55
P2RX1 P51575 1/20 0.52
P2RX3 P56373 1/20 0.52
P2RX4 Q99571 1/20 0.52
GAA P10253 1/20 0.52
OR51E2 Q9H255 1/20 0.51
AMD1 P17707 2/20 0.49
ADORA3 P0DMS8 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
DPP4 P27487 1/20 0.49
MEN1 O00255 1/20 0.49
SLC28A1 O00337 1/20 0.49
MAP3K7 O43318 1/20 0.49

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
SCHEMBL28950087 0.91 PI4KA (0.77) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL16256552 0.90 PI4KA (0.78) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL30586379 0.90 PI4KA (0.78) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL11760852 0.90 PI4KA (0.65) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL8461173 0.90 PI4KA (0.65) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL9225984 0.90 PI4KA (0.68) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL9122399 0.89 PI4KA (0.64) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL19003199 0.89 PI4KA (0.74) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL24146588 0.89 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL22393059 0.89 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024177959-A1 SMALL MOLECULE TRACER LIGANDS FOR AMINOACYL-TRNA SYNTHETASE ASSAYS THE GENERAL HOSPITAL CORPORATION (US) 2024-08-29 WO disclosed
US-7989430-B2 Antibacterial agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2011-08-02 US disclosed
US-20080293666-A1 Antibacterial Agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2008-11-27 US disclosed
US-7189706-B2 C2,5′-disubstituted and N6,C2,5′-trisubstituted adenosine derivatives and pharmaceutical compositions containing them UNIVERSITEIT LEIDEN (NL) 2007-03-13 US disclosed
US-7084127-B2 C2,5′-disubstituted and N6, C2,5′-trisubstituted adenosine derivatives and their different uses UNIVERSITEIT LEIDEN (NL) 2006-08-01 US disclosed
US-6958324-B2 Inosine compounds and their use for treating or preventing an inflamation or a reperfusion disease INOTEK PHARMACEUTICALS CORPORATION (US) 2005-10-25 US disclosed
US-20050203052-A1 Inosine compounds and methods of use thereof INOTEK PHARMACEUTICALS CORPORATION 2005-09-15 US disclosed
US-20050014715-A1 Inosine compounds and their use for treating or preventing an inflammation or reperfusion disease SALZMAN ANDREW L (US) 2005-01-20 US disclosed
EP-1469003-A2 Tetraphosphonate bicyclic trisanhydrides Pharmasset, Ltd. (US) 2004-10-20 EP disclosed
US-20040181078-A1 Tetraphosphonate bicyclic trisanhydrides PHARMASSET, LTD. 2004-09-16 US disclosed
US-20030040502-A1 Inosine compounds and their use for treating or preventing an inflamation or a reperfusion disease INOTEK PHARMACEUTICALS CORPORATION 2003-02-27 US disclosed
US-20020161220-A1 Tetraphosphonate bicyclic trisanhydrides GILEAD PHARMASSET LLC 2002-10-31 US disclosed
US-6326490-B1 ANTIPROLIFERATION AGENTS OR ANTICARCINOGENIC AGENTS PHARMASSET, LTD. 2001-12-04 US disclosed
US-5864033-A ENZYME INHIBITORS WITH HETEROCYCLIC BASES METABASIS THERAPEUTICS, INC. (US) 1999-01-26 US disclosed
US-5846743-A Polyphoshoinositide binding peptides for intracellular drug delivery BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 1998-12-08 US disclosed
US-5783662-A Polyphosphoinsitide binding peptides for intracellular drug delivery BRIGHAM & WOMEN'S HOSPITAL, INC. (US) 1998-07-21 US disclosed
WO-1998020887-A1 POLYPHOSPHOINOSITIDE BINDING PEPTIDES FOR INTRACELLULAR DRUG DELIVERY BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 1998-05-22 WO disclosed
US-5646128-A TREATING INFLAMMATION, SEPSIS, SEPTIC SHOCK, BURNS GENSIA, INC. (US) 1997-07-08 US disclosed
US-5213972-A Production of thymidine and deoxyuridine, intermediates for AZT CHEMGEN CORPORATION (US) 1993-05-25 US disclosed
WO-1992012718-A1 ADENOSINE KINASE INHIBITORS GENSIA, INC. (US) 1992-08-06 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 (6 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-20050203052-A1 Inosine compounds and methods of use thereof NOS2, NOS1, ARG2 PI4KA 3067/4885PI4K2B 3234/4885PI4K2A 2981/4885
US-20030040502-A1 Inosine compounds and their use for treating or preventing an inflamation or a reperfusion disease NOS2, NOS1, ARG2 PI4KA 3190/4885PI4K2B 3683/4885PI4K2A 3235/4885
US-20050014715-A1 Inosine compounds and their use for treating or preventing an inflammation or reperfusion disease NOS2, NOS1, NOS3 PI4KA 2634/4885PI4K2B 3027/4885PI4K2A 2656/4885
US-20080293666-A1 Antibacterial Agents MRPL21, ABCB7, MSR1 PI4KA 4490/4885PI4K2B 3867/4885PI4K2A 4444/4885
US-20040181078-A1 Tetraphosphonate bicyclic trisanhydrides IDH1, PPIP5K2, DHPS PI4KA 857/4885PI4K2B 1224/4885PI4K2A 917/4885
US-20020161220-A1 Tetraphosphonate bicyclic trisanhydrides IDH1, PPIP5K2, DHPS PI4KA 857/4885PI4K2B 1224/4885PI4K2A 917/4885

“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.