SCHEMBL16076780

SCHEMBL16076780

C[C@]1(OCCc2ccccc2)O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 8/20 0.42
SLC5A1 P13866 5/20 0.40
MAOB P27338 1/20 0.39
SYNJ2 O15056 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ABL1 P00519 1/20 0.39
ALPL P05186 1/20 0.39
POLB P06746 1/20 0.39
ALPI P09923 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALPG P10696 1/20 0.39
PABPC1 P11940 1/20 0.39
RECQL P46063 1/20 0.39
GALK1 P51570 1/20 0.39
CASP7 P55210 1/20 0.39
CASP6 P55212 1/20 0.39
MCL1 Q07820 1/20 0.39
RIN1 Q13671 1/20 0.39
EIF4H Q15056 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
SCHEMBL16027279 0.80 PLK1 (0.44) SLC5A2SLC5A1
SCHEMBL16027277 0.80 PLK1 (0.44) SLC5A2SLC5A1
SCHEMBL6009962 0.78 SLC5A1 (0.39) SLC5A2SLC5A1
SCHEMBL27730458 0.78 SLC5A2 (0.38) SLC5A2SLC5A1MAOBSYNJ2KDM4E
SCHEMBL8654353 0.77 PYGB (0.37) SLC5A2SLC5A1
SCHEMBL6003949 0.74 LGALS9 (0.44) SLC5A2SLC5A1MAOB
SCHEMBL29202951 0.73 PYGB (0.41) SLC5A2SLC5A1
SCHEMBL27840040 0.72 SLC5A2 (0.45) SLC5A2SLC5A1SYNJ2KDM4EABL1
SCHEMBL27497543 0.72 SLC5A2 (0.45) SLC5A2SLC5A1SYNJ2KDM4EABL1
SCHEMBL1522142 0.72 PYGB (0.45) SLC5A2SLC5A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970353-B1 MANNOSE DERIVATIVES FOR TREATING BACTERIAL INFECTIONS VERTEX PHARMA (US) 2018-04-18 EP disclosed
US-9890176-B2 Mannose derivatives for treating bacterial infections VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-02-13 US disclosed
US-9890176-B2 Mannose derivatives for treating bacterial infections VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-02-13 US disclosed
WO-2014165107-A2 MANNOSE DERIVATIVES FOR TREATING BACTERIAL INFECTIONS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-10-09 WO disclosed
US-20140274930-A1 MANNOSE DERIVATIVES FOR TREATING BACTERIAL INFECTIONS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-09-18 US disclosed
US-20140274930-A1 MANNOSE DERIVATIVES FOR TREATING BACTERIAL INFECTIONS VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-09-18 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-20140274930-A1 MANNOSE DERIVATIVES FOR TREATING BACTERIAL INFECTIONS TLR5, TLR1, MANBA SLC5A2 138/4885SLC5A1 99/4885MAOB 1156/4885

“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.