SCHEMBL10177099

SCHEMBL10177099

CC[C@H]1OC(O)(c2ccc(OC)c(C=O)c2)[C@H](OCc2ccccc2)[C@@H](C)[C@@H]1OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 8/20 0.39
EDNRA P25101 4/20 0.33
TUBB1 Q9H4B7 1/20 0.32
EDNRB P24530 3/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
ALDH1A1 P00352 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL16090884 0.93 ERN1 (0.39) ERN1EDNRATUBB1EDNRBNPC1
SCHEMBL16727618 0.93 ERN1 (0.40) ERN1EDNRATUBB1EDNRBNPC1
SCHEMBL18521911 0.87 EDNRA (0.35) EDNRAEDNRBNPC1RAB9AHPGD
SCHEMBL10328199 0.86 ERN1 (0.38) ERN1EDNRATUBB1EDNRB
SCHEMBL14617865 0.86 ERN1 (0.38) ERN1EDNRATUBB1EDNRB
SCHEMBL2087673 0.84 ERN1 (0.39) ERN1
SCHEMBL10177100 0.74 GJB2 (0.33) NPC1RAB9ASMN1; SMN2PKM
SCHEMBL18521910 0.74 GJB2 (0.33) NPC1RAB9ASMN1; SMN2PKM
SCHEMBL146539 0.72 PTGER1 (0.39) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL10177098 0.72

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-8163704-B2 Glycoside derivatives and uses thereof NOVARTIS AG (CH) 2012-04-24 US disclosed
US-20110171159-A1 Glycoside Derivatives and Uses Thereof NOVARTIS AG (CH) 2011-07-14 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-20110171159-A1 Glycoside Derivatives and Uses Thereof SLC5A1, SLC5A2, SLC2A1 ERN1 2914/4885EDNRA 904/4885TUBB1 4400/4885

“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.