SCHEMBL2290209

SCHEMBL2290209

CC(C)(C)OC(=O)C(O[Si](C)(C)C(C)(C)C)(C(=O)OC(C)(C)C)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.54
PI4K2B Q8TCG2 1/20 0.54
PI4K2A Q9BTU6 1/20 0.54
PI4KB Q9UBF8 1/20 0.54
RXFP1 Q9HBX9 1/20 0.51
P2RX1 P51575 1/20 0.49
P2RX3 P56373 1/20 0.49
P2RX4 Q99571 1/20 0.49
ADORA3 P0DMS8 2/20 0.45
ADORA2B P29275 2/20 0.45
AMD1 P17707 2/20 0.45
AHCY P23526 4/20 0.44
DOT1L Q8TEK3 1/20 0.43
HSP90B1 P14625 2/20 0.43
HIF1A Q16665 1/20 0.43
TMEM97 Q5BJF2 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
ADORA2A P29274 1/20 0.43
TSHR P16473 1/20 0.42

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
SCHEMBL2288126 0.80 PI4KA (0.54) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL2291569 0.79 PI4KA (0.58) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL888230 0.79 AHCY (0.46) ADORA3ADORA2BAHCYDOT1LHSP90B1
SCHEMBL2291899 0.78 PI4KA (0.69) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL888137 0.77 AHCY (0.42) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL2291893 0.77 PI4KA (0.67) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL2288491 0.76 RXFP1 (0.61) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL2291588 0.75 RXFP1 (0.53) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL2294899 0.75 RXFP1 (0.53) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL24146635 0.75 PI4KA (0.70) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20080293666-A1 Antibacterial Agents MRPL21, ABCB7, MSR1 PI4KA 4490/4885PI4K2B 3867/4885PI4K2A 4444/4885

“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.