SCHEMBL4920635

SCHEMBL4920635

O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](c2n[nH]c3cncnc23)[C@H](O)[C@@H]1O

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 5/20 0.57
▸ P2RY2 P41231 10/20 0.51
▸ P2RY4 P51582 2/20 0.51
▸ UMPS P11172 1/20 0.45
▸ P2RX2 Q9UBL9 4/20 0.44
▸ P2RX4 Q99571 1/20 0.43
▸ P2RY1 P47900 3/20 0.43
▸ P2RX1 P51575 1/20 0.43

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
SCHEMBL14190569 0.90 UMPS (0.54) P2RX3P2RY2P2RY4UMPSP2RY1
SCHEMBL29881649 0.83 P2RY1 (0.53) P2RX3P2RY2P2RY4P2RX2P2RX4
SCHEMBL18490376 0.83 P2RY1 (0.53) P2RX3P2RY2P2RY4P2RX2P2RX4
SCHEMBL10053225 0.83 P2RY1 (0.53) P2RX3P2RY2P2RY4P2RX2P2RX4
SCHEMBL10021598 0.83 P2RY1 (0.53) P2RX3P2RY2P2RY4P2RX2P2RX4
Deaminoformycin SCHEMBL14217783 0.77 HIF1A (0.46) UMPS
Deaminoformycin SCHEMBL5071997 0.77 HIF1A (0.46) UMPS
SCHEMBL29420237 0.76 P2RX1 (0.55) P2RX3P2RY2P2RX2P2RX4P2RY1
SCHEMBL18510879 0.75 P2RY2 (0.54) P2RX3P2RY2P2RY4UMPSP2RX2
SCHEMBL18079925 0.74 P2RY2 (0.53) P2RX3P2RY2P2RY4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7423143-B2 Nucleic acid labeling compounds AFFYMETRIX. INC. (US) 2008-09-09 — — US disclosed
US-7291463-B2 Incubating/condensating pseudoisocytidine molecule with (1-(3-dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride to provide a pseudouridine molecule; oncology diagnosis AFFYMETRIX, INC. (US) 2007-11-06 — — US disclosed
US-7282327-B2 Nucleic acid labeling compounds AFFYMETRIX, INC. (US) 2007-10-16 — — US disclosed
US-20050287563-A1 Nucleic acid labeling compounds AFFYMETRIX, INC. 2005-12-29 — — US disclosed
US-6965020-B2 Nucleic acid labeling compounds AFFYMETRIX, INC. (US) 2005-11-15 — — US disclosed
US-6864059-B2 Biotin containing C-glycoside nucleic acid labeling compounds AFFYMETRIX, INC. (US) 2005-03-08 — — US disclosed
US-20050003496-A1 Incubating/condensating pseudoisocytidine molecule with (1-(3-dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride to provide a pseudouridine molecule; oncology diagnosis AFFYMETRIX, INC. (US) 2005-01-06 — — US disclosed
US-20040210045-A1 Nucleic acid labeling compounds MCGALL GLENN (US) 2004-10-21 — — US disclosed
US-20040101892-A1 Nucleic acid labeling compounds AFFYMETRIX, INC. 2004-05-27 — — US disclosed
US-20030180757-A1 Nucleic acid labeling compounds AFFYMETRIX, INC. 2003-09-25 — — US disclosed
US-20020165372-A1 Nucleic acid labeling compounds AFFYMETRIX, INC. 2002-11-07 — — 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 (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-20030180757-A1 Nucleic acid labeling compounds RNGTT, DUT, FBL P2RX3 3527/4885P2RY2 3816/4885P2RY4 3087/4885
US-20040101892-A1 Nucleic acid labeling compounds RNGTT, DUT, FBL P2RX3 3527/4885P2RY2 3816/4885P2RY4 3087/4885
US-20050287563-A1 Nucleic acid labeling compounds RNGTT, DUT, FBL P2RX3 3527/4885P2RY2 3816/4885P2RY4 3087/4885
US-20020165372-A1 Nucleic acid labeling compounds RNGTT, DUT, FBL P2RX3 3527/4885P2RY2 3816/4885P2RY4 3087/4885
US-20050003496-A1 Incubating/condensating pseudoisocytidine molecule with (1-(3-dimethylaminopropyl)-3-ethylcarbodiimide hydrochloride to provide a pseudouridine molecule; oncology diagnosis DUT, PCNA, BCDIN3D P2RX3 4661/4885P2RY2 4360/4885P2RY4 3886/4885
US-20040210045-A1 Nucleic acid labeling compounds RNGTT, DUT, FBL P2RX3 3527/4885P2RY2 3816/4885P2RY4 3087/4885

“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