SCHEMBL19003377

SCHEMBL19003377

CN(C(=O)OC(C)(C)C)c1ccc(Br)cc1N(C)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 8/20 0.41
NCEH1 Q6PIU2 3/20 0.40
NPC1 O15118 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BRD4 O60885 1/20 0.36
PAX8 Q06710 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
FPR3 P25089 1/20 0.33
FPR2 P25090 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
SCHEMBL30175909 1.00 AAK1 (0.41) AAK1NCEH1NPC1RECQLRAB9A
SCHEMBL20671184 0.88 AAK1 (0.40) AAK1NCEH1NPC1RECQLRAB9A
SCHEMBL16096043 0.88 AAK1 (0.40) AAK1NCEH1NPC1RECQLRAB9A
SCHEMBL30116140 0.88 AAK1 (0.40) AAK1NCEH1NPC1RECQLRAB9A
SCHEMBL28896606 0.86 ALDH1A1 (0.45) AAK1NCEH1NPC1RECQLRAB9A
SCHEMBL30829434 0.86 ALDH1A1 (0.45) AAK1NCEH1NPC1RECQLRAB9A
SCHEMBL27634058 0.86 AAK1 (0.49) AAK1NCEH1NPC1RECQLRAB9A
SCHEMBL4015276 0.86 SIRT2 (0.43) AAK1NCEH1NPC1RAB9ASMN1; SMN2
Methane SCHEMBL27428599 0.84 POLB (0.40) AAK1NCEH1SMN1; SMN2ALDH1A1PTGDR2
SCHEMBL21789125 0.83 NR4A2 (0.41) AAK1NCEH1NPC1RECQLRAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11730055-B2 Dopant, charge transfer salt and organic electronic device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2023-08-15 US disclosed
US-11730055-B2 Dopant, charge transfer salt and organic electronic device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2023-08-15 US disclosed
WO-2017103610-A1 DOPANT, CHARGE TRANSFER SALT AND ORGANIC ELECTRONIC DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2017-06-22 WO disclosed
WO-2017103609-A1 CHARGE TRANSFER SALT, ELECTRONIC DEVICE AND METHOD OF FORMING THE SAME CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2017-06-22 WO 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-11730055-B2 Dopant, charge transfer salt and organic electronic device CHRM1, SLC6A3, DRD1 AAK1 4095/4885NCEH1 914/4885NPC1 1234/4885

“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.