SCHEMBL1673979

SCHEMBL1673979

C=CCO[C@H]1O[C@H](COCc2ccccc2)[C@@H](O)[C@H](OC(C)=O)[C@H]1NC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
KMT2A Q03164 1/20 0.49
POLB P06746 2/20 0.48
SSTR4 P31391 3/20 0.41
TP53 P04637 2/20 0.41
MDM2 Q00987 2/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
SLC6A2 P23975 1/20 0.39
MDM4 O15151 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
SSTR2 P30874 3/20 0.39
SSTR3 P32745 3/20 0.39
SSTR5 P35346 3/20 0.39
SSTR1 P30872 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL8822949 0.93 SSTR4 (0.47) LMNAKMT2APOLBSSTR4TP53
SCHEMBL1673982 0.92 LMNA (0.55) LMNAKMT2APOLBTP53MDM2
SCHEMBL10905976 0.91 SSTR4 (0.46) LMNAKMT2APOLBSSTR4TP53
SCHEMBL10905974 0.91 SSTR4 (0.46) LMNAKMT2APOLBSSTR4TP53
SCHEMBL6760495 0.91 POLB (0.57) LMNAKMT2APOLBSSTR4TP53
SCHEMBL2503954 0.89 LMNA (0.58) LMNAKMT2APOLBSSTR4TP53
SCHEMBL2503960 0.89 LMNA (0.58) LMNAKMT2APOLBSSTR4TP53
SCHEMBL7582813 0.86 LGALS8 (0.42) LMNAKMT2ASSTR4ALDH1A1SLC6A2
SCHEMBL8822954 0.86 TP53 (0.49) LMNAKMT2APOLBTP53MDM2
SCHEMBL8822957 0.85 LMNA (0.57) LMNAKMT2APOLBALDH1A1CYP3A4

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-20110086767-A1 MUTANTS OF GLYCOSIDE HYDROLASES AND USES THEREOF FOR SYNTHESIZING COMPLEX OLIGOSACCHARIDES AND DISACCHARIDE INTERMEDIATES INSTITUT PASTEUR 2011-04-14 US disclosed
EP-2100965-A1 Mutants of glycoside hydrolases and uses thereof for synthesizing complex oligosaccharides and disaccharide intermediates Institut Pasteur (FR) 2009-09-16 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-20110086767-A1 MUTANTS OF GLYCOSIDE HYDROLASES AND USES THEREOF FOR SYNTHESIZING COMPLEX OLIGOSACCHARIDES AND DISACCHARIDE INTERMEDIATES ENGASE, GALE, MGAM LMNA 3194/4885KMT2A 2916/4885POLB 1672/4885

“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.