SCHEMBL14429337

SCHEMBL14429337

CCC1(CC)O[C@@H]2CC[C@@H](COC(C)=O)OC(OC(C)=O)[C@@H]2O1

nearest known ligand 0.31

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.31
THRB P10828 2/20 0.31
HSD17B10 Q99714 1/20 0.31
NR3C1 P04150 1/20 0.30
FYN P06241 1/20 0.30
ADRA2A P08913 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADRA2B P18089 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30
CYP3A4 P08684 2/20 0.30
MAPT P10636 2/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL14429352 0.81 CYP2D6 (0.31) CYP2D6THRBHSD17B10NR3C1FYN
SCHEMBL14429341 0.81 CYP2D6 (0.31) CYP2D6THRBHSD17B10NR3C1FYN
SCHEMBL14568802 0.74 PPP5C (0.39) THRBHSD17B10CYP3A4MAPTCYP2C19
SCHEMBL14429307 0.72 THRB (0.40) CYP2D6THRBHSD17B10NR3C1FYN
SCHEMBL14429325 0.72 THRB (0.40) CYP2D6THRBHSD17B10NR3C1FYN
SCHEMBL14429335 0.70 CA2 (0.41) CYP2D6THRBHSD17B10NR3C1FYN
SCHEMBL14429334 0.69
SCHEMBL24632392 0.68 TSHR (0.40) CYP2D6THRBHSD17B10NR3C1FYN
SCHEMBL6981519 0.68 TSHR (0.40) CYP2D6THRBHSD17B10NR3C1FYN
SCHEMBL9911316 0.68 TSHR (0.40) CYP2D6THRBHSD17B10NR3C1FYN

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-20070185063-A1 Seven-membered ring nucleosides IDENIX PHARMACEUTICALS, INC. 2007-08-09 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-20070185063-A1 Seven-membered ring nucleosides NSUN2, NSUN3, HAVCR2 CYP2D6 1720/4885THRB 4696/4885HSD17B10 2101/4885

“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.