SCHEMBL14429286

SCHEMBL14429286

COC(=O)C=C[C@H](OCc1ccccc1)[C@H](OCc1ccccc1)[C@H](O)COCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
HTT P42858 1/20 0.42
CTSL P07711 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MAPT P10636 1/20 0.39
CA1 P00915 3/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
FOLH1 Q04609 1/20 0.38
PPARA Q07869 1/20 0.38
MME P08473 1/20 0.36
TACR1 P25103 1/20 0.36
SLC1A1 P43005 1/20 0.36
RCE1 Q9Y256 1/20 0.36

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
SCHEMBL5852058 0.88 CA1 (0.41) KMT2AHTTCYP2C9CYP2C19MAPT
SCHEMBL21283006 0.84 MAPT (0.46) KMT2AHTTCYP3A4CYP2C9CYP2C19
SCHEMBL5981947 0.83 KMT2A (0.45) KMT2AHTTCYP2C19MAPTCA1
SCHEMBL18868657 0.82 MAPT (0.45) KMT2AHTTCYP3A4CYP2C9CYP2C19
SCHEMBL5981210 0.81 HTT (0.45) KMT2AHTTCYP3A4CYP2C9CYP2C19
SCHEMBL3751041 0.80 CA1 (0.45) KMT2AHTTCYP3A4CYP2C9CYP2C19
SCHEMBL1561831 0.80 CA1 (0.45) KMT2AHTTCYP3A4CYP2C9CYP2C19
SCHEMBL1263178 0.80 CA1 (0.45) KMT2AHTTCYP3A4CYP2C9CYP2C19
SCHEMBL2562479 0.80 CA1 (0.45) KMT2AHTTCYP3A4CYP2C9CYP2C19
SCHEMBL19970649 0.80 CA1 (0.45) KMT2AHTTCYP3A4CYP2C9CYP2C19

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 KMT2A 3044/4885HTT 3228/4885CTSL 2360/4885

“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.