SCHEMBL2886488

SCHEMBL2886488

CC(C)c1ccc(OC(=O)c2ccccc2)c(OC(=O)c2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
KMT2A Q03164 5/20 0.49
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MEN1 O00255 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
CYP3A4 P08684 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
SLC6A3 Q01959 1/20 0.47
ESR1 P03372 2/20 0.46
ESR2 Q92731 2/20 0.46
HSD17B10 Q99714 2/20 0.46
JAK2 O60674 1/20 0.46
USP2 O75604 1/20 0.46
GAA P10253 1/20 0.46
ALOX15 P16050 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
PARP1 P09874 1/20 0.44

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
SCHEMBL249602 0.88 MEN1 (0.58) KMT2AMAPTMEN1
SCHEMBL28681789 0.87 ALDH1A1 (0.43) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL9221084 0.83 KMT2A (0.47) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL21252722 0.81 KMT2A (0.49) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL23318972 0.80 HIF1A (0.66) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL11257064 0.79 CYP3A4 (0.45) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL11430447 0.79 KMT2A (0.44) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL498198 0.79 MAPT (0.44) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL2500899 0.79 MAPT (0.46) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1
SCHEMBL11418687 0.79 KMT2A (0.49) ALDH1A1KMT2AMAPTSMN1; SMN2MEN1

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
WO-2022270478-A1 ANTIVIRAL AGENT 国立大学法人北海道大学 2022-12-29 WO disclosed
US-8604235-B2 Production of substituted phenylene aromatic diesters and compositions DOW GLOBAL TECHNOLOGIES LLC (US) 2013-12-10 US disclosed
US-20100204506-A1 Production of Substituted Phenylene Aromatic Diesters and Compositions W. R. GRACE & CO.-CONN. 2010-08-12 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-20100204506-A1 Production of Substituted Phenylene Aromatic Diesters and Compositions PAH, DDC, DDT ALDH1A1 240/4885KMT2A 1611/4885MAPT 2384/4885

“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.