SCHEMBL29324495

SCHEMBL29324495

N#Cc1cccc(OC2CCCCC2)n1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.51
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
KCNH2 Q12809 1/20 0.40
MGLL Q99685 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
BRD4 O60885 1/20 0.39
MCHR1 Q99705 2/20 0.39
HRH3 Q9Y5N1 2/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38
PDE9A O76083 2/20 0.38
LOX P28300 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37
PDGFRB P09619 1/20 0.35
PDGFRA P16234 1/20 0.35
PIM1 P11309 1/20 0.35
PIM3 Q86V86 1/20 0.35
PIM2 Q9P1W9 1/20 0.35

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
SCHEMBL25087455 0.95 CTSK (0.45) CTSKSLC6A2SLC6A4KCNH2MGLL
SCHEMBL27226089 0.84 HRH1 (0.44) CTSKSLC6A2SLC6A4KCNH2MGLL
SCHEMBL3613521 0.82 HRH3 (0.55) CTSKSLC6A2SLC6A4KCNH2MGLL
SCHEMBL31546854 0.79 FFAR4 (0.38) SLC6A2SLC6A4KCNH2FFAR4BRD4
SCHEMBL3602567 0.78 MGLL (0.55) KCNH2MGLLFFAR4HRH3
SCHEMBL4442024 0.77 HRH3 (0.49) MGLLHRH3
SCHEMBL31546824 0.75 FFAR4 (0.36) SLC6A2SLC6A4KCNH2FFAR4BRD4
SCHEMBL31581118 0.75 MCHR1 (0.42) SLC6A2SLC6A4KCNH2FFAR4BRD4
SCHEMBL2144242 0.75 MCHR1 (0.56) SLC6A2SLC6A4KCNH2FFAR4BRD4
SCHEMBL958367 0.75 MCHR1 (0.45) SLC6A2SLC6A4KCNH2FFAR4BRD4

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-20240239797-A1 AKT1 MODULATORS ALTEROME THERAPEUTICS, INC. 2024-07-18 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-20240239797-A1 AKT1 MODULATORS AKT1S1, AKT1, AKT2 CTSK 2726/4885SLC6A2 4281/4885SLC6A4 4124/4885

“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.