SCHEMBL763280

SCHEMBL763280

CC(COC(=O)NCCO)COC(=O)NCCO

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.54
CHRNB4 P30926 2/20 0.54
CHRNA3 P32297 2/20 0.54
CHRNA4 P43681 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.45
ACHE P22303 13/20 0.44
ALOX15 P16050 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.38

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
SCHEMBL604897 0.88 CHRNB2 (0.54) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL10749335 0.86 CHRNB2 (0.53) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL17663562 0.80 ACHE (0.66) ACHEALOX15
SCHEMBL19356087 0.79 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL12107388 0.78 SMN1; SMN2 (0.58) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL15249135 0.78 CHRNB2 (0.45) CHRNB2CHRNB4CHRNA3CHRNA4SMN1; SMN2
SCHEMBL12537122 0.77 EPHX1 (0.61) ACHEALOX15
SCHEMBL12537126 0.77 EPHX1 (0.61) ACHEALOX15
SCHEMBL12537124 0.77 EPHX1 (0.61) ACHEALOX15
SCHEMBL12537129 0.77 EPHX1 (0.61) ACHEALOX15

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-8137700-B2 Main chain acid-degradable polymers for the delivery of bioactive materials U.S. DEPARTMENT OF ENERGY (US) 2012-03-20 US disclosed
US-20090220615-A1 Main Chain Acid-Degradable Polymers for the Delivery of Bioactive Materials THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2009-09-03 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-20090220615-A1 Main Chain Acid-Degradable Polymers for the Delivery of Bioactive Materials CTSA, GAA, CTSB CHRNB2 4247/4885CHRNB4 4667/4885CHRNA3 4631/4885

“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.