SCHEMBL22837183

SCHEMBL22837183

CC1OC[C@H]([C@H]2OC[C@H](O)[C@H]2O)O1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 4/20 0.38
CHRM5 P08912 4/20 0.38
CHRM1 P11229 4/20 0.38
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM3 P20309 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL18802700 1.00 THRB (0.42) THRBLMNACHRM2CHRM5CHRM1
SCHEMBL18596480 0.86 THRB (0.36) THRBLMNACHRM2CHRM5CHRM1
SCHEMBL14532196 0.80 THRB (0.52) THRBLMNA
SCHEMBL3469193 0.77 THRB (0.55) THRBLMNA
SCHEMBL15496477 0.77 THRB (0.55) THRBLMNA
SCHEMBL9604672 0.77 THRB (0.44) THRBLMNACHRM2CHRM5CHRM1
SCHEMBL22837190 0.75 THRB (0.38) THRBLMNA
SCHEMBL29306262 0.75 CHRM2 (0.35) CHRM2CHRM5CHRM1
SCHEMBL19760529 0.75 THRB (0.38) THRBLMNA
SCHEMBL15703229 0.75 CHRM2 (0.35) CHRM2CHRM5CHRM1

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-10874103-B2 Antibacterial composition comprising an acetal or a long-chain alkyl hexitane ether TEREOS STARCH & SWEETENERS BELGIUM (BE) 2020-12-29 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-10874103-B2 Antibacterial composition comprising an acetal or a long-chain alkyl hexitane ether AAAS, AADAC, DPM1 THRB 3491/4885LMNA 2772/4885CHRM2 4800/4885

“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.