SCHEMBL903023

SCHEMBL903023

Nc1nc(=O)n(C2OC(COP(=O)(O)O)C(O)C2O)cc1I

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 4/20 0.55
FBP1 P09467 2/20 0.55
DNPH1 O43598 2/20 0.55
PRKAB2 O43741 1/20 0.55
TRPM2 O94759 1/20 0.55
LDHA P00338 1/20 0.55
ADRB2 P07550 1/20 0.55
SRC P12931 1/20 0.55
ADORA1 P30542 1/20 0.55
P2RY1 P47900 1/20 0.55
PRKAG1 P54619 1/20 0.55
PRKAA2 P54646 1/20 0.55
PDE4D Q08499 1/20 0.55
KCNH2 Q12809 1/20 0.55
PRKAA1 Q13131 1/20 0.55
PDE3A Q14432 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
TAS1R3 Q7RTX0 1/20 0.55
TAS1R1 Q7RTX1 1/20 0.55
P2RY11 Q96G91 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
SCHEMBL3469888 1.00 P2RY2 (0.55) P2RY2FBP1DNPH1PRKAB2TRPM2
SCHEMBL17789098 1.00 P2RY2 (0.55) P2RY2FBP1DNPH1PRKAB2TRPM2
SCHEMBL16489876 1.00 P2RY2 (0.55) P2RY2FBP1DNPH1PRKAB2TRPM2
SCHEMBL17809091 1.00 P2RY2 (0.55) P2RY2FBP1DNPH1PRKAB2TRPM2
SCHEMBL14946156 1.00 P2RY2 (0.55) P2RY2FBP1DNPH1PRKAB2TRPM2
SCHEMBL5501347 1.00 P2RY2 (0.55) P2RY2FBP1DNPH1PRKAB2TRPM2
SCHEMBL625445 0.90 P2RY2 (0.62) P2RY2P2RY1P2RY11P2RY6P2RY4
SCHEMBL3503039 0.90 P2RY2 (0.62) P2RY2P2RY1P2RY11P2RY6P2RY4
SCHEMBL21742739 0.90 P2RY6 (0.66) P2RY6P2RY14NT5E
SCHEMBL11511464 0.88 P2RY2 (0.56) P2RY2FBP1DNPH1PRKAB2TRPM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4108671-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ModernaTX, Inc. (US) 2022-12-28 EP disclosed
EP-3590949-B1 RIBONUCLEIC ACIDS CONTAINING N1-METHYL-PSEUDOURACILS AND USES THEREOF MODERNATX INC (US) 2022-05-18 EP disclosed
EP-3590949-A1 RIBONUCLEIC ACIDS CONTAINING N1-METHYL-PSEUDOURACILS AND USES THEREOF ModernaTX, Inc. (US) 2020-01-08 EP disclosed
US-20190160185-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNA THERAPEUTICS, INC. 2019-05-30 US disclosed
EP-2622064-B1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNATX INC (US) 2019-05-29 EP disclosed
US-20170239374-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ARES CAPITAL CORPORATION, AS AGENT 2017-08-24 US disclosed
US-20170239374-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ARES CAPITAL CORPORATION, AS AGENT 2017-08-24 US disclosed
US-9657295-B2 Modified nucleosides, nucleotides, and nucleic acids, and uses thereof MODERNATX, INC. (US) 2017-05-23 US disclosed
US-9657295-B2 Modified nucleosides, nucleotides, and nucleic acids, and uses thereof MODERNATX, INC. (US) 2017-05-23 US disclosed
US-20160264975-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ARES CAPITAL CORPORATION, AS AGENT 2016-09-15 US disclosed
US-20160022774-A1 DIAGNOSIS AND TREATMENT OF FIBROSIS MODERNATX, INC. 2016-01-28 US disclosed
US-20140371302-A1 MODIFIED MRNAS ENCODING CELL-PENETRATING POLYPEPTIDES MODERNATX, INC. 2014-12-18 US disclosed
US-20140371302-A1 MODIFIED MRNAS ENCODING CELL-PENETRATING POLYPEPTIDES MODERNATX, INC. 2014-12-18 US disclosed
WO-2014158795-A1 DIAGNOSIS AND TREATMENT OF FIBROSIS MODERNA THERAPEUTICS, INC. (US) 2014-10-02 WO disclosed
US-20130203115-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2013-08-08 US disclosed
US-20130203115-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNA THERAPEUTICS, INC. (US) 2013-08-08 US disclosed
WO-2013101690-A1 MODIFIED MRNAS ENCODING CELL-PENETRATING POLYPEPTIDES modeRNA Therapeutics (US) 2013-07-04 WO disclosed
US-20130102034-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNATX, INC. 2013-04-25 US disclosed
US-20130102034-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF MODERNATX, INC. 2013-04-25 US disclosed
WO-2012045075-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF SCHRUM JASON (US) 2012-04-05 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 (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-20160022774-A1 DIAGNOSIS AND TREATMENT OF FIBROSIS MMP1, COL2A1, COL1A1 P2RY2 2517/4885FBP1 3425/4885DNPH1 4562/4885
US-20170239374-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, RNMT P2RY2 622/4885FBP1 1693/4885DNPH1 402/4885
US-20190160185-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, RNMT P2RY2 622/4885FBP1 1693/4885DNPH1 402/4885
US-20130102034-A1 MODIFIED NUCLEOSIDES, NUCLEOTIDES, AND NUCLEIC ACIDS, AND USES THEREOF ADAR, NT5C3B, RNMT P2RY2 622/4885FBP1 1693/4885DNPH1 402/4885

“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.