SCHEMBL26355441

SCHEMBL26355441

CN(C)C(=O)c1ccc(N(C)I)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.55
ALDH1A1 P00352 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
PDK2 Q15119 5/20 0.47
HSP90AA1 P07900 1/20 0.47
MAPT P10636 2/20 0.45
ERN1 O75460 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PDK4 Q16654 4/20 0.40
PDK1 Q15118 3/20 0.40
PDK3 Q15120 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
EPHX2 P34913 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
LRRK2 Q5S007 1/20 0.39
NCOA1 Q15788 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
SCHEMBL1004649 0.83 ALDH1A1 (0.73) HPGDALDH1A1SMN1; SMN2PDK2HSP90AA1
SCHEMBL24783913 0.82 ALDH1A1 (0.67) HPGDALDH1A1SMN1; SMN2PDK2HSP90AA1
SCHEMBL19663875 0.80 NPC1 (0.55) HPGDALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL20003185 0.80 MAPT (0.55) HPGDALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL643967 0.77 ALDH1A1 (0.59) HPGDALDH1A1SMN1; SMN2PDK2HSP90AA1
SCHEMBL19601225 0.77 MAPT (0.79) HPGDALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL14293288 0.77 NOTUM (0.59) HPGDALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL10626283 0.77 ALDH1A1 (0.64) HPGDALDH1A1SMN1; SMN2PDK2MAPT
SCHEMBL17681603 0.75 HPGD (0.52) HPGDALDH1A1SMN1; SMN2PDK2HSP90AA1
SCHEMBL1300109 0.75 ALDH1A1 (0.61) HPGDALDH1A1SMN1; SMN2PDK2HSP90AA1

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-20230301984-A1 CYCLIC COMPOUNDS FOR USE IN TREATING RETINAL DEGENERATION THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-09-28 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-20230301984-A1 CYCLIC COMPOUNDS FOR USE IN TREATING RETINAL DEGENERATION ALDH1A2, PDE6D, PDE6C HPGD 401/4885ALDH1A1 145/4885SMN1; SMN2 107/4885

“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.