SCHEMBL16084863

SCHEMBL16084863

CC1O[C@@H](OCCC(=O)O)[C@@H](O)C[C@H]1O

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ IGF2R P11717 1/20 0.36
▸ CHRM5 P08912 2/20 0.35
▸ CHRM1 P11229 2/20 0.35
▸ CHRM3 P20309 2/20 0.35
▸ CHRM2 P08172 1/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ TK1 P04183 3/20 0.33

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
SCHEMBL30163822 1.00 IGF2R (0.36) IGF2RCHRM5CHRM1CHRM3CHRM2
SCHEMBL17531586 1.00 IGF2R (0.36) IGF2RCHRM5CHRM1CHRM3CHRM2
SCHEMBL16154497 0.89 ALDH1A1 (0.39) IGF2RCHRM5CHRM1CHRM3CHRM2
SCHEMBL16145424 0.89 ALDH1A1 (0.39) IGF2RCHRM5CHRM1CHRM3CHRM2
SCHEMBL14704264 0.89 ALDH1A1 (0.39) IGF2RCHRM5CHRM1CHRM3CHRM2
SCHEMBL30163856 0.89 ALDH1A1 (0.39) IGF2RCHRM5CHRM1CHRM3CHRM2
SCHEMBL24721233 0.88 ALDH1A1 (0.41) IGF2RTSHRTK1
SCHEMBL16084870 0.88 ALDH1A1 (0.41) IGF2RTSHRTK1
SCHEMBL16154509 0.88 ALDH1A1 (0.41) IGF2RTSHRTK1
SCHEMBL30465016 0.88 ALDH1A1 (0.41) IGF2RTSHRTK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021007282-A1 COMPOSITIONS AND METHODS FOR ENHANCING PLANT GROWTH BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. (US) 2021-01-14 — — WO disclosed
WO-2021007280-A1 COMPOSITIONS AND METHODS FOR MODULATING MICROBIOMES BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. (US) 2021-01-14 — — WO disclosed
WO-2020214901-A1 COMPOSITIONS AND METHODS FOR MODULATING IMMUNITY IN PLANTS BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. (US) 2020-10-22 — — WO disclosed
US-9445596-B2 Small molecule compounds for the control of nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2016-09-20 — — US disclosed
US-20160037741-A1 COMPOSITIONS AND METHODS FOR MODULATING IMMUNITY IN PLANTS BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. 2016-02-11 — — US disclosed
US-20140303360-A1 Small Molecule Compounds for the Control of Nematodes CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2014-10-09 — — US disclosed
WO-2014145380-A2 COMPOSITIONS AND METHODS FOR MODULATING IMMUNITY IN PLANTS BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. (US) 2014-09-18 — — 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 (2 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-20160037741-A1 COMPOSITIONS AND METHODS FOR MODULATING IMMUNITY IN PLANTS SLC11A2, IFNG, STING1 IGF2R 3444/4885CHRM5 2595/4885CHRM1 3514/4885
US-20140303360-A1 Small Molecule Compounds for the Control of Nematodes MAVS, EMG1, PINK1 IGF2R 3605/4885CHRM5 2748/4885CHRM1 3842/4885

“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.

Send feedback