SCHEMBL4899890

SCHEMBL4899890

CC(C)(C)[Si](C)(C)OC[C@@H]1[C@H](O)C[C@H](OCc2ccccc2)C[C@@H]1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.34
OPRM1 P35372 2/20 0.32
OPRL1 P41146 2/20 0.32
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSK P43235 1/20 0.32
SLC18A3 Q16572 2/20 0.31
BCHE P06276 1/20 0.31
TOP2A P11388 1/20 0.31
GABRA5 P31644 1/20 0.31
FFAR1 O14842 1/20 0.31

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
SCHEMBL7493619 1.00 PDE4D (0.34) PDE4DOPRM1OPRL1CTSLCTSB
SCHEMBL6575559 0.89 PDE4D (0.39) PDE4DOPRM1OPRL1CTSLCTSB
SCHEMBL14107808 0.84 CTSL (0.37) PDE4DOPRM1OPRL1CTSLCTSB
SCHEMBL4893196 0.84 CTSL (0.37) PDE4DOPRM1OPRL1CTSLCTSB
SCHEMBL4919336 0.83 TOP2A (0.31) TOP2A
SCHEMBL4919332 0.83 TOP2A (0.31) TOP2A
SCHEMBL724384 0.79 NAAA (0.41) OPRM1OPRL1CTSLCTSBCTSK
SCHEMBL4895151 0.78 CTSL (0.36) OPRM1OPRL1CTSLCTSBCTSK
SCHEMBL14107809 0.78 CTSL (0.36) OPRM1OPRL1CTSLCTSBCTSK
SCHEMBL22906947 0.77 CTSL (0.41) OPRM1OPRL1CTSLCTSBCTSK

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-20080176813-A1 CARBOCYCLIC NUCLEOSIDES AND PROCESS FOR OBTAINING SUCH STICHTING REGA VZW (BE) 2008-07-24 US disclosed
EP-1210347-B1 CARBOCYCLIC NUCLEOSIDES AND PROCESS FOR OBTAINING SUCH STICHTING REGA V Z W (BE) 2004-06-23 EP 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-20080176813-A1 CARBOCYCLIC NUCLEOSIDES AND PROCESS FOR OBTAINING SUCH ATIC, ADORA2A, ADORA3 PDE4D 2097/4885OPRM1 401/4885OPRL1 1152/4885

“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.