SCHEMBL2882737

SCHEMBL2882737

CC(C)c1cc(OC(=O)c2ccccc2)c(OC(=O)c2ccccc2)c(-c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.42
MAPT P10636 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
BACE1 P56817 1/20 0.41
SLC6A3 Q01959 1/20 0.41
MEN1 O00255 5/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
JAK2 O60674 1/20 0.40
USP2 O75604 1/20 0.40
GAA P10253 1/20 0.40
ALOX15 P16050 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 1/20 0.39
PTGS1 P23219 3/20 0.39
PTGS2 P35354 2/20 0.39

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
SCHEMBL498198 0.86 MAPT (0.44) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL2500899 0.83 MAPT (0.46) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL2482056 0.82 KMT2A (0.45) KMT2AMAPTSMN1; SMN2BACE1SLC6A3
SCHEMBL2508951 0.81 MAPT (0.47) KMT2AMAPTSMN1; SMN2BACE1SLC6A3
SCHEMBL2483378 0.81 MAPT (0.42) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL2481446 0.81 KMT2A (0.43) KMT2AMAPTSMN1; SMN2BACE1SLC6A3
SCHEMBL2482165 0.80 KMT2A (0.46) KMT2AMAPTSMN1; SMN2BACE1SLC6A3
SCHEMBL2480717 0.80 PDCD1 (0.44) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL2484142 0.79 MAPT (0.41) KMT2AMAPTSMN1; SMN2SLC6A3MEN1
SCHEMBL2483526 0.78 MAPT (0.51) KMT2AMAPTSMN1; SMN2BACE1SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 KMT2A 1611/4885MAPT 2384/4885SMN1; SMN2 4422/4885

“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.