SCHEMBL25745271

SCHEMBL25745271

CC(C)c1nc2c(ncn2C(C)(C)C)c(=O)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.39
PI4K2B Q8TCG2 1/20 0.39
PI4K2A Q9BTU6 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
XDH P47989 5/20 0.35
KDM5B Q9UGL1 2/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
HPRT1 P00492 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
NFKB1 P19838 1/20 0.32
BLM P54132 1/20 0.32
VCP P55072 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HIF1A Q16665 1/20 0.32
IMPDH2 P12268 1/20 0.32

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
SCHEMBL25768778 0.86 IMPDH2 (0.36) XDHCDK4CCND1HPRT1MEN1
SCHEMBL17898192 0.80 CDK1 (0.38) XDHCDK4CCND1HPRT1ALDH1A1
SCHEMBL12702573 0.80 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBXDH
SCHEMBL22942542 0.79 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBXDH
SCHEMBL5021598 0.79 XDH (0.55) PI4KAPI4K2BPI4K2API4KBXDH
SCHEMBL22571137 0.79 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBXDH
SCHEMBL22901682 0.79 HPGD (0.43) PI4KAPI4K2BPI4K2API4KBXDH
SCHEMBL22907592 0.79 CDK2 (0.46) PI4KAPI4K2BPI4K2API4KBXDH
SCHEMBL22942534 0.77 HPGD (0.41) PI4KAPI4K2BPI4K2API4KBXDH
SCHEMBL14725444 0.77 PI4KA (0.39) PI4KAPI4K2BPI4K2API4KBXDH

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-20230203084-A1 SENSITIVE OLIGONUCLEOTIDE SYNTHESIS USING SULFUR-BASED FUNCTIONS AS PROTECTING GROUPS AND LINKERS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-06-29 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-20230203084-A1 SENSITIVE OLIGONUCLEOTIDE SYNTHESIS USING SULFUR-BASED FUNCTIONS AS PROTECTING GROUPS AND LINKERS RNGTT, MTAP, RNMT PI4KA 2540/4885PI4K2B 1689/4885PI4K2A 2004/4885

“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.