SCHEMBL4819105

SCHEMBL4819105

NCCCCCCOP(N)(=O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 10/20 0.70
▸ P2RY2 P41231 3/20 0.70
▸ SRC P12931 2/20 0.70
▸ SMN1; SMN2 Q16637 2/20 0.70
▸ TRPM2 O94759 2/20 0.70
▸ TAS1R3 Q7RTX0 2/20 0.70
▸ TAS1R1 Q7RTX1 2/20 0.70
▸ P2RY11 Q96G91 2/20 0.70
▸ DNPH1 O43598 1/20 0.70
▸ PRKAB2 O43741 1/20 0.70
▸ LDHA P00338 1/20 0.70
▸ ADRB2 P07550 1/20 0.70
▸ FBP1 P09467 1/20 0.70
▸ ADORA1 P30542 1/20 0.70
▸ PRKAG1 P54619 1/20 0.70
▸ PRKAA2 P54646 1/20 0.70
▸ PDE4D Q08499 1/20 0.70
▸ KCNH2 Q12809 1/20 0.70
▸ PRKAA1 Q13131 1/20 0.70
▸ PDE3A Q14432 1/20 0.70

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
SCHEMBL4825208 0.99 P2RY1 (0.72) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL1513014 0.91 P2RY1 (0.77) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL4823848 0.90 P2RY1 (0.70) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL2167873 0.89 P2RY1 (0.84) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL10886673 0.86 DOT1L (0.66) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL2167816 0.86 P2RY1 (0.86) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL8007640 0.85 DOT1L (0.65) P2RY1P2RY2SRCSMN1; SMN2TRPM2
Adenosine Phosphate SCHEMBL2515775 0.85 P2RY1 (0.81) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL3487544 0.85 P2RY1 (0.84) P2RY1P2RY2SRCSMN1; SMN2TRPM2
SCHEMBL31001551 0.85 P2RY1 (0.61) P2RY1P2RY2SRCSMN1; SMN2TRPM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040241649-A1 RNA CONTAINING COENZYMES, BIOTIN, OR FLUOROPHORES, AND METHODS FOR THEIR PREPARATION AND USE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2004-12-02 — — US claimed
US-7323319-B2 RNA containing coenzymes, biotin, or fluorophores, and methods for their preparation and use THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2008-01-29 — — US disclosed
US-20040241649-A1 RNA CONTAINING COENZYMES, BIOTIN, OR FLUOROPHORES, AND METHODS FOR THEIR PREPARATION AND USE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2004-12-02 — — US disclosed
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