SCHEMBL24721233

SCHEMBL24721233

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ TBXA2R P21731 1/20 0.35
▸ PTGFR P43088 1/20 0.35
▸ PTGER2 P43116 1/20 0.35
▸ TSHR P16473 5/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ PMP22 Q01453 1/20 0.34
▸ PPARG P37231 8/20 0.34
▸ PPARD Q03181 7/20 0.34
▸ PPARA Q07869 7/20 0.34
▸ TK1 P04183 1/20 0.34
▸ GPR84 Q9NQS5 5/20 0.33
▸ HDAC11 Q96DB2 5/20 0.33
▸ TLR2 O60603 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ FABP4 P15090 2/20 0.33
▸ PTPN1 P18031 2/20 0.33
▸ SLC22A6 Q4U2R8 1/20 0.33
▸ SLC22A8 Q8TCC7 1/20 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
SCHEMBL30465016 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL30465046 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL29779646 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL29779648 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL16084870 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL30465062 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL16145439 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL16154509 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL30465054 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR
SCHEMBL30465037 1.00 ALDH1A1 (0.41) ALDH1A1TBXA2RPTGFRPTGER2TSHR

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-20220248672-A1 COMPOSITIONS AND METHODS FOR MODULATING MICROBIOMES BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. 2022-08-11 — — 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-20220248672-A1 COMPOSITIONS AND METHODS FOR MODULATING MICROBIOMES VIP, FABP2, FBL ALDH1A1 2756/4885TBXA2R 1368/4885PTGFR 2771/4885

“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.

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