SCHEMBL2415464

SCHEMBL2415464

CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@@H](Oc2cccc(-c3cccnc3F)c2)SC[C@H]1OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
DHODH Q02127 7/20 0.35
GSK3B P49841 1/20 0.34
BACE1 P56817 8/20 0.33
CTSD P07339 7/20 0.33
GRM5 P41594 1/20 0.33
BACE2 Q9Y5Z0 6/20 0.33
CYP2C19 P33261 1/20 0.32
GRIA2 P42262 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
SCHEMBL2415462 1.00 PRMT5 (0.36) PRMT5WDR77DHODHGSK3BBACE1
SCHEMBL2410913 0.91 ABL1 (0.37) DHODH
SCHEMBL2410909 0.91 ABL1 (0.37) DHODH
SCHEMBL3400655 0.89 CHRNB2 (0.36) GSK3BGRM5
SCHEMBL315735 0.89 CHRNB2 (0.36) GSK3BGRM5
SCHEMBL2409949 0.89 RXFP1 (0.36) DHODH
SCHEMBL2409951 0.89 RXFP1 (0.36) DHODH
SCHEMBL2412530 0.88 ABL1 (0.35) DHODH
SCHEMBL2412528 0.88 ABL1 (0.35) DHODH
SCHEMBL2416234 0.87 DHODH (0.37) DHODH

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-8013010-B2 5-thioxylopyranose compounds LABORATOIRES FOURNIER S.A. (FR) 2011-09-06 US disclosed
US-20090186840-A1 5-Thioxylopyranose Compounds LABORATOIRES FOURNIER S.A (FR) 2009-07-23 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-20090186840-A1 5-Thioxylopyranose Compounds TPMT, PNPO, CYP3A5 PRMT5 961/4885WDR77 3751/4885DHODH 83/4885

“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.