SCHEMBL17857934

SCHEMBL17857934

CCCCCCCCCCCCOCC1O[C@H](OC)C(O)[C@@H](O)[C@H]1O

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GJB2 P29033 4/20 0.48
TLR4 O00206 1/20 0.45
TNF P01375 1/20 0.44
IGF2R P11717 4/20 0.43
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
G6PD P11413 1/20 0.42
GBA1 P04062 1/20 0.41
MAPK1 P28482 1/20 0.40

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
SCHEMBL19682034 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL19682108 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL19682024 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL19666048 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL20537365 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL19678130 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL10799573 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL19678119 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL20536768 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1
SCHEMBL19681977 1.00 GJB2 (0.48) GJB2TLR4TNFIGF2RALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170347653-A1 ANTIBACTERIAL COMPOSITION CONTAINING AN ISOMER MIXTURE OF MONOSACCHARIDE ALKYL MONOACETALS OR MONOETHERS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-12-07 US disclosed
WO-2017103904-A1 ANTIBACTERIAL COMPOSITION CONTAINING A DEOXYHEXOSE ALKYL MONOACETAL OR MONOETHER TEREOS STARCH & SWEETENERS BELGIUM (BE) 2017-06-22 WO disclosed
WO-2016098046-A1 ANTIBACTERIAL COMPOSITION CONTAINING AN ISOMER MIXTURE OF MONOSACCHARIDE ALKYL MONOACETALS OR MONOETHERS SYRAL BELGIUM NV (BE) 2016-06-23 WO 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-20170347653-A1 ANTIBACTERIAL COMPOSITION CONTAINING AN ISOMER MIXTURE OF MONOSACCHARIDE ALKYL MONOACETALS OR MONOETHERS GNE, MGAM, GALE GJB2 3588/4885TLR4 484/4885TNF 1776/4885

“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.