SCHEMBL12901989

SCHEMBL12901989

CC(C)OC[C@H]1O[C@@](CO)(O[C@H]2OC(CO)[C@@H](O)C(O)C2O)C(O)C1O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.67
CCNB1 P14635 1/20 0.67
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ADORA1 P30542 1/20 0.41
LDHA P00338 1/20 0.41
EPHX2 P34913 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.36
TYR P14679 1/20 0.36
MAPT P10636 1/20 0.36
POLB P06746 1/20 0.36
SYNJ2 O15056 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
SCHEMBL13870087 1.00 CDK1 (0.67) CDK1CCNB1CA2CA9MEN1
SCHEMBL24125775 1.00 CDK1 (0.67) CDK1CCNB1CA2CA9MEN1
SCHEMBL13109355 1.00 CDK1 (0.67) CDK1CCNB1CA2CA9MEN1
SCHEMBL17165136 0.87 CDK1 (0.69) CDK1CCNB1CA2CA9MEN1
SCHEMBL8071486 0.86 CDK1 (0.71) CDK1CCNB1CA2CA9MEN1
SCHEMBL12940199 0.86 CDK1 (0.71) CDK1CCNB1CA2CA9MEN1
SCHEMBL8994672 0.86 CDK1 (0.67) CDK1CCNB1CA2CA9MEN1
Sucrose SCHEMBL25403456 0.86 CDK1 (0.82) CDK1CCNB1CA2CA9MEN1
Sucrose SCHEMBL23690724 0.86 CDK1 (0.82) CDK1CCNB1CA2CA9MEN1
Sucrose SCHEMBL23690443 0.86 CDK1 (0.82) CDK1CCNB1CA2CA9MEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110033422-A1 TREATMENTS FOR FLAVIVIRIDAE VIRUS INFECTION SCHERING CORPORATION 2011-02-10 US disclosed
US-7816339-B2 Treatments for Flaviviridae virus infection SCHERING CORPORATION (US) 2010-10-19 US disclosed
US-20090209483-A1 TREATMENTS FOR FLAVIVIRIDAE VIRUS INFECTION SCHERING CORPORATION 2009-08-20 US disclosed
US-7524831-B2 Treatments for Flaviviridae virus infection SCHERING CORPORATION (US) 2009-04-28 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-20110033422-A1 TREATMENTS FOR FLAVIVIRIDAE VIRUS INFECTION HAVCR2, EIF2AK2, HNRNPC CDK1 3832/4885CCNB1 3609/4885CA2 4248/4885
US-20090209483-A1 TREATMENTS FOR FLAVIVIRIDAE VIRUS INFECTION HAVCR2, EIF2AK2, HNRNPC CDK1 3832/4885CCNB1 3609/4885CA2 4248/4885

“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.