SCHEMBL6353732

SCHEMBL6353732

CC(C)CN(CC(C)C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(C#N)cc2C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.57
SMN1; SMN2 Q16637 4/20 0.56
LMNA P02545 3/20 0.56
POLB P06746 1/20 0.56
SIRT2 Q8IXJ6 7/20 0.51
ALB P02768 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TSHR P16473 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 2/20 0.45
GFER P55789 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
SCHEMBL6359077 0.89 ALB (0.56) APEX1SMN1; SMN2LMNAPOLBALB
SCHEMBL6352948 0.85 APEX1 (0.63) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6352310 0.84 APEX1 (0.52) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6353472 0.84 APEX1 (0.56) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6357082 0.84 APEX1 (0.56) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6349541 0.83 SIRT2 (0.51) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6352026 0.83 SIRT2 (0.51) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6357891 0.83 APEX1 (0.51) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6352847 0.82 SIRT2 (0.52) APEX1SMN1; SMN2LMNAPOLBSIRT2
SCHEMBL6352574 0.82 APEX1 (0.54) APEX1SMN1; SMN2LMNAPOLBSIRT2

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-20050113450-A1 Antibacterial agents PHARMACIA & UPJOHN COMPANY 2005-05-26 US claimed

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-20050113450-A1 Antibacterial agents CLPP, SPOUT1, SAMHD1 APEX1 502/4885SMN1; SMN2 3015/4885LMNA 4552/4885

“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.