SCHEMBL13748558

SCHEMBL13748558

CC(=O)C(C)(C)CCCCN

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 3/20 0.44
FDPS P14324 2/20 0.40
ACLY P53396 1/20 0.38
NFKB1 P19838 2/20 0.37
CYP2D6 P10635 1/20 0.37
ACACB O00763 1/20 0.36
ACACA Q13085 1/20 0.36
BLM P54132 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
LMNA P02545 2/20 0.36
THRB P10828 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PLG P00747 1/20 0.36
ALOX15 P16050 1/20 0.36
SLC6A2 P23975 1/20 0.36
RECQL P46063 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CPB2 Q96IY4 1/20 0.35

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
SCHEMBL17520226 0.93 PAOX (0.41) PAOXFDPSACLYNFKB1CYP2D6
SCHEMBL11880739 0.85 ACLY (0.48) ACLYACACBACACACYP4F2CYP4A11
SCHEMBL9355622 0.83 FDPS (0.41) PAOXFDPSACLYNFKB1CYP2D6
SCHEMBL16259499 0.82
SCHEMBL13400167 0.82 GAA (0.40) ACLYACACBACACAALDH1A1CYP4F2
SCHEMBL9718212 0.81 ACLY (0.57) PAOXFDPSACLYNFKB1CYP2D6
SCHEMBL10870280 0.79 ACLY (0.61) PAOXFDPSACLYNFKB1CYP2D6
SCHEMBL28439734 0.79 ACLY (0.61) PAOXFDPSACLYNFKB1CYP2D6
SCHEMBL10869894 0.79 ACLY (0.61) PAOXFDPSACLYNFKB1CYP2D6
SCHEMBL25726352 0.79 PAOX (0.43) PAOXFDPSNFKB1CYP2D6BLM

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-8367065-B2 Targeted polymeric prodrugs containing multifunctional linkers ENZON PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-20090202573-A1 POLYMERIC CONJUGATES CONTAINING POSITIVELY-CHARGED MOIETIES ENZON PHARMACEUTICALS, INC. (US) 2009-08-13 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-20090202573-A1 POLYMERIC CONJUGATES CONTAINING POSITIVELY-CHARGED MOIETIES PIGO, PHOSPHO1, PAICS PAOX 2907/4885FDPS 4642/4885ACLY 4185/4885

“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.