SCHEMBL18026171

SCHEMBL18026171

CC(O)[C@H]1O[C@@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.44
▸ PRMT5 O14744 3/20 0.44
▸ WDR77 Q9BQA1 3/20 0.44
▸ PI4KA P42356 1/20 0.43
▸ PI4K2B Q8TCG2 1/20 0.43
▸ PI4K2A Q9BTU6 1/20 0.43
▸ PI4KB Q9UBF8 1/20 0.43
▸ ADORA2A P29274 2/20 0.43
▸ ADORA2B P29275 2/20 0.43
▸ P2RY12 Q9H244 2/20 0.43

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
SCHEMBL18009901 1.00 PRMT6 (0.44) PRMT6PRMT5WDR77PI4KAPI4K2B
SCHEMBL22435074 0.94 PRMT6 (0.45) PRMT6PRMT5WDR77PI4KAPI4K2B
SCHEMBL19344404 0.94 PRMT6 (0.45) PRMT6PRMT5WDR77PI4KAPI4K2B
SCHEMBL14113287 0.87 P2RY12 (0.54) ADORA2AADORA2BP2RY12
SCHEMBL18009928 0.86 P2RY12 (0.47) PRMT6PI4KAPI4K2BPI4K2API4KB
SCHEMBL14113328 0.85 P2RY12 (0.45) PI4KAPI4K2BPI4K2API4KBP2RY12
SCHEMBL22601403 0.85 PI4KA (0.62) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL22402681 0.85 PI4KA (0.62) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL29444514 0.85 PI4KA (0.62) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL16378775 0.85 PI4KA (0.62) PI4KAPI4K2BPI4K2API4KBADORA2A

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-10428104-B2 Substituted nucleoside derivatives useful as anticancer agents PFIZER INC. (US) 2019-10-01 — — US disclosed
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 (2 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-10428104-B2 Substituted nucleoside derivatives useful as anticancer agents TYMP, NME1, DPYD PRMT6 1736/4885PRMT5 1543/4885WDR77 2428/4885
US-20160244475-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES USEFUL AS ANTICANCER AGENTS TYMP, NME1, PNP PRMT6 1741/4885PRMT5 1552/4885WDR77 2124/4885

“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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