SCHEMBL24915926

SCHEMBL24915926

CCc1cc(C(=O)NCCN(C)C)c2nc(C)cc(C(C)C)c2c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 3/20 0.42
TLR8 Q9NR97 3/20 0.42
TLR7 Q9NYK1 3/20 0.42
HTT P42858 2/20 0.42
RAD52 P43351 5/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
UHRF1 Q96T88 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 1/20 0.39
AOX1 Q06278 1/20 0.39
USP2 O75604 1/20 0.37
JAK2 O60674 1/20 0.37
HPGD P15428 1/20 0.37
ALOX12 P18054 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL24915922 0.86 MEN1 (0.40) ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL24915920 0.83 L3MBTL1 (0.37) TLR8TLR7HTTSMN1; SMN2ALDH1A1
SCHEMBL24916059 0.77 POLB (0.41) SMN1; SMN2ALDH1A1KDM4E
SCHEMBL24916001 0.73 HTT (0.44) HTTRAD52SMN1; SMN2UHRF1ALDH1A1
SCHEMBL29923768 0.71 EGLN1 (0.52) HTTRAD52SMN1; SMN2UHRF1ALDH1A1
SCHEMBL24915997 0.70 GPR52 (0.39) ALDH1A1KDM4E
SCHEMBL24916013 0.70 MAP4K4 (0.40) TLR8TLR7
SCHEMBL9607575 0.67 ALDH1A1 (0.43) TLR9TLR8TLR7HTTSMN1; SMN2
SCHEMBL7033962 0.67 AOX1 (0.69) HTTRAD52SMN1; SMN2UHRF1ALDH1A1
SCHEMBL24916053 0.67 DHFR (0.43) KDM4EUSP2

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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 TLR9 4379/4885TLR8 4298/4885TLR7 4346/4885

“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.