SCHEMBL31402244

SCHEMBL31402244

CC(C)(C)OC(=O)CCCCCCCn1ccc(N)n1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 11/20 0.41
TDP1 Q9NUW8 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
ALOX15 P16050 1/20 0.40
HDAC8 Q9BY41 2/20 0.36
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
EPHX2 P34913 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
PTGIR P43119 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTR4 Q13639 1/20 0.33

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
SCHEMBL31402252 1.00 EP300 (0.41) EP300TDP1KDM4ECYP1A2CYP2D6
SCHEMBL31402264 1.00 EP300 (0.41) EP300TDP1KDM4ECYP1A2CYP2D6
SCHEMBL31402325 0.99 TDP1 (0.40) EP300TDP1KDM4ECYP1A2CYP2D6
SCHEMBL31402230 0.95 TDP1 (0.36) EP300TDP1KDM4ECYP1A2CYP2D6
SCHEMBL1862488 0.89 ALDH1A1 (0.35) TDP1KDM4ECYP1A2CYP2D6ALOX15
SCHEMBL11120553 0.83 KDM4E (0.43) EP300TDP1KDM4ECYP1A2CYP2D6
SCHEMBL1860579 0.80 ALDH1A1 (0.40) TDP1KDM4EHDAC6ALDH1A1
SCHEMBL25261116 0.79 SCN9A (0.40) TDP1KDM4EHDAC8HDAC3HDAC1
SCHEMBL2818119 0.79 TDP1 (0.42) EP300TDP1KDM4ECYP1A2CYP2D6
SCHEMBL10784428 0.78 TDP1 (0.53) EP300TDP1KDM4ECYP1A2CYP2D6

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-20250074891-A1 BIFUNCTIONAL SULPHONAMIDE COMPOUNDS Anaxis Pharma Pty Ltd (AU) 2025-03-06 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-20250074891-A1 BIFUNCTIONAL SULPHONAMIDE COMPOUNDS MLKL, RIPK3, CASP9 EP300 4588/4885TDP1 454/4885KDM4E 937/4885

“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.