SCHEMBL2289573

SCHEMBL2289573

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

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 3/20 0.39
PI4K2B Q8TCG2 3/20 0.39
PI4K2A Q9BTU6 3/20 0.39
PI4KB Q9UBF8 3/20 0.39
RXFP1 Q9HBX9 2/20 0.38
ATG7 O95352 6/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
NFKB1 P19838 1/20 0.35
THPO P40225 1/20 0.35
BLM P54132 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL2293030 0.78 RXFP1 (0.42) RXFP1ATG7
SCHEMBL2291620 0.78 TRPM2 (0.40)
SCHEMBL9851782 0.77 PI4KA (0.31) PI4KAPI4K2BPI4K2API4KB
SCHEMBL4649016 0.73 RXFP1 (0.40) PI4KAPI4K2BPI4K2API4KBRXFP1
SCHEMBL9851849 0.71
SCHEMBL7893477 0.70 ADORA3 (0.44) PI4KAPI4K2BPI4K2API4KBSMN1; SMN2
SCHEMBL9548680 0.69 ADORA3 (0.37) PI4KAPI4K2BPI4K2API4KBCYP1A2
SCHEMBL9218681 0.69 ADORA1 (0.44) PI4KAPI4K2BPI4K2API4KBSMN1; SMN2
SCHEMBL25389129 0.69 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBSMN1; SMN2
SCHEMBL9548802 0.69 ADORA2A (0.42) PI4KAPI4K2BPI4K2API4KB

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.