SCHEMBL29324912

SCHEMBL29324912

CC1(C)OC2[C@H](O[C@H](COC(=O)c3ccccc3)C2(C)O)O1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.60
HPGD P15428 1/20 0.46
MAPK1 P28482 2/20 0.45
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CES2 O00748 1/20 0.41
LMNA P02545 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNA5 P30532 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
NPC1 O15118 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
PPM1B O75688 1/20 0.37
HIF1A Q16665 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL21418918 1.00 ALDH1A1 (0.60) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL16576319 1.00 ALDH1A1 (0.60) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL20557340 1.00 ALDH1A1 (0.60) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL20721517 0.85 ALDH1A1 (0.55) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL7208356 0.85 ALDH1A1 (0.55) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL27195153 0.85 ALDH1A1 (0.55) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL7159964 0.85 ALDH1A1 (0.55) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL27195158 0.85 ALDH1A1 (0.55) ALDH1A1HPGDMAPK1POLBGAA
SCHEMBL14036873 0.84 ALDH1A1 (0.43) ALDH1A1HPGDNPC1TDP1TSHR
SCHEMBL14010468 0.84 ALDH1A1 (0.43) ALDH1A1HPGDNPC1TDP1TSHR

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-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES EMORY UNIVERSITY 2024-07-18 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-20240238323-A1 MODIFIED NUCLEOSIDES AND NUCLEOTIDES ANALOGS AS ANTIVIRAL AGENTS FOR CORONA AND OTHER VIRUSES MTAP, PNP, SARS1 ALDH1A1 1929/4885HPGD 3721/4885MAPK1 2415/4885

“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.