SCHEMBL25756742

SCHEMBL25756742

CC1(C)OC2[C@H](O1)[C@H](CO[Si](C)(C)C(C)(C)C)O[C@@H]2n1cnc2c(N)ncnc21

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.70
PI4K2B Q8TCG2 2/20 0.70
PI4K2A Q9BTU6 2/20 0.70
PI4KB Q9UBF8 2/20 0.70
RXFP1 Q9HBX9 1/20 0.69
P2RX3 P56373 4/20 0.63
P2RX1 P51575 3/20 0.63
P2RX4 Q99571 3/20 0.63
AMD1 P17707 2/20 0.58
GAA P10253 1/20 0.49
ADORA1 P30542 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
DPP4 P27487 1/20 0.47
MEN1 O00255 1/20 0.47
SLC28A1 O00337 1/20 0.47
MAP3K7 O43318 1/20 0.47
SLC28A2 O43868 1/20 0.47
GAPDH P04406 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL21377709 1.00 PI4KA (0.70) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL2291014 1.00 PI4KA (0.70) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL30546911 1.00 PI4KA (0.70) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL24146635 1.00 PI4KA (0.70) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL13309395 0.90 P2RX3 (0.64) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL1795275 0.89 RXFP1 (0.54) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL1795964 0.89 RXFP1 (0.54) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL1795283 0.89 RXFP1 (0.54) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL1795966 0.89 RXFP1 (0.54) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL14429043 0.87 PI4KA (0.58) PI4KAPI4K2BPI4K2API4KBRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212213-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT UNIV OREGON HEALTH & SCIENCE (US) 2023-07-06 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 (1 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-20230212213-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT SARM1, PARP16, NAMPT PI4KA 3648/4885PI4K2B 3024/4885PI4K2A 3294/4885

“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.