SCHEMBL18026249

SCHEMBL18026249

CC[C@H]1O[C@@H](n2cc(F)c3c(Cl)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.44
▸ PI4K2B Q8TCG2 1/20 0.44
▸ PI4K2A Q9BTU6 1/20 0.44
▸ PI4KB Q9UBF8 1/20 0.44
▸ ADK P55263 12/20 0.41
▸ SLC29A1 Q99808 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ PRMT5 O14744 2/20 0.39
▸ WDR77 Q9BQA1 2/20 0.39

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
SCHEMBL18535300 0.91 PI4KA (0.55) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL18009754 0.91 PI4KA (0.55) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL18026298 0.88 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL68579 0.87 ADK (0.56) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL18009687 0.86 PI4KA (0.40) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL10131208 0.85 RXFP1 (0.42) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL325253 0.85 RXFP1 (0.42) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL19344078 0.82 PRMT5 (0.38) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL18009946 0.81 PRMT5 (0.40) PI4KAPI4K2BPI4K2API4KBADK
SCHEMBL18009746 0.81 ADK (0.40) PI4KAPI4K2BPI4K2API4KBADK

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-20160244475-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER INC. (US) 2016-08-25 — — 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-20160244475-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS TYMP, NME1, PNP PI4KA 989/4885PI4K2B 1184/4885PI4K2A 1232/4885

“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.

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