SCHEMBL6764009

SCHEMBL6764009

CCOC(=O)c1cc(OC(=O)c2ccccc2)c(OC(=O)c2ccccc2)c(OC(=O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.54
LMNA P02545 3/20 0.54
ALDH1A1 P00352 3/20 0.54
SMN1; SMN2 Q16637 6/20 0.52
GAA P10253 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MEN1 O00255 1/20 0.50
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HSD17B2 P37059 1/20 0.47
MAPT P10636 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL6761365 0.88 LMNA (0.69) KMT2ALMNAALDH1A1SMN1; SMN2NPC1
SCHEMBL6763979 0.86 LMNA (0.56) KMT2ALMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL6762669 0.85 TDP1 (0.58) KMT2ALMNAALDH1A1NPC1RAB9A
SCHEMBL6767313 0.84 KMT2A (0.68) KMT2ALMNAALDH1A1SMN1; SMN2GAA
SCHEMBL6759838 0.83 KMT2A (0.50) KMT2ALMNAALDH1A1SMN1; SMN2GAA
SCHEMBL6766253 0.83 TSHR (0.63) KMT2ALMNASMN1; SMN2NPC1RAB9A
Ethyl Benzoate SCHEMBL25388294 0.82 LMNA (0.70) KMT2ALMNAALDH1A1SMN1; SMN2GAA
Ethyl Benzoate SCHEMBL55674 0.82 LMNA (0.70) KMT2ALMNAALDH1A1SMN1; SMN2GAA
Ethyl Benzoate SCHEMBL2762273 0.82 LMNA (0.70) KMT2ALMNAALDH1A1SMN1; SMN2GAA
SCHEMBL6761495 0.81 LMNA (0.63) KMT2ALMNAALDH1A1NPC1RAB9A

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-20040247698-A1 Erectile Dysfunction Treatment VALENZUELA CORTES CARMEN MARIA (CL) 2004-12-09 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-20040247698-A1 Erectile Dysfunction Treatment PDE3A, PDE3B, PDE12 KMT2A 2816/4885LMNA 1504/4885ALDH1A1 1744/4885

“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.