SCHEMBL1260980

SCHEMBL1260980

CC(C)(C)OC(=O)N1C[C@H](Oc2cccc(OCc3ccccc3)n2)C[C@@]1(C)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 7/20 0.37
GRIN2B Q13224 1/20 0.37
GHSR Q92847 4/20 0.36
MAOB P27338 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
KCNH2 Q12809 1/20 0.35
GRM5 P41594 1/20 0.35
ACHE P22303 1/20 0.35
USP30 Q70CQ3 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
SCHEMBL1260528 0.86 USP30 (0.33) JAK1USP30
SCHEMBL1260709 0.85 HSD11B1 (0.35) USP30
SCHEMBL704571 0.83 ABCB1 (0.41) PRMT5JAK2JAK1USP30
SCHEMBL27223224 0.83 ABCB1 (0.41) PRMT5JAK2JAK1USP30
SCHEMBL23043429 0.83 ABCB1 (0.41) PRMT5JAK2JAK1USP30
SCHEMBL16106798 0.80 PRMT5 (0.35) PRMT5GRIN2B
SCHEMBL2439748 0.79 USP30 (0.47) USP30
SCHEMBL10196271 0.78 PRMT5 (0.52) PRMT5
SCHEMBL1260700 0.77 MCL1 (0.47) PRMT5GHSR
SCHEMBL12093209 0.77 GPR119 (0.50) PRMT5KCNH2

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-20110046161-A1 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME LLC 2011-02-24 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-20110046161-A1 HCV NS3 PROTEASE INHIBITORS HAVCR2, GTF3C3, CTSC PRMT5 2225/4885GRIN2B 4806/4885GHSR 4437/4885

“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.