SCHEMBL18503746

SCHEMBL18503746

CC[C@]12O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)C(OC13CC3)[C@H]2OP(C)OCCC#N

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 10/20 0.38
▸ PRMT6 Q96LA8 1/20 0.37

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
SCHEMBL18708182 1.00 P2RY12 (0.38) P2RY12PRMT6
SCHEMBL18503745 0.83 ADORA2A (0.47) P2RY12
SCHEMBL18708181 0.83 ADORA2A (0.47) P2RY12
SCHEMBL18503734 0.83 ABL1 (0.32) —
SCHEMBL18708173 0.83 ABL1 (0.32) —
SCHEMBL18503744 0.82 BMPR1B (0.43) P2RY12PRMT6
SCHEMBL18708183 0.82 BMPR1B (0.43) P2RY12PRMT6
SCHEMBL13164828 0.82 PRMT6 (0.35) P2RY12PRMT6
SCHEMBL12851767 0.81 PRMT6 (0.36) P2RY12PRMT6
SCHEMBL18510987 0.78 PRMT6 (0.36) P2RY12PRMT6

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-20170044528-A1 CROSSLINKED NUCLEOSIDE AND NUCLEOTIDE OSAKA UNIVERSITY (JP) 2017-02-16 — — 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-20170044528-A1 CROSSLINKED NUCLEOSIDE AND NUCLEOTIDE NSUN2, NCL, NSUN3 P2RY12 2878/4885PRMT6 3331/4885

“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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