SCHEMBL29344283

SCHEMBL29344283

CC(C)(C)OC(=O)N1C2(C)CC(=O)C1(C)CN(Cc1ccccc1)C2

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.44
NPFFR1 Q9GZQ6 1/20 0.40
NPFFR2 Q9Y5X5 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
ACHE P22303 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP2D6 P10635 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
STS P08842 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL30998421 1.00 GAA (0.44) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL29937097 0.87 GAA (0.51) GAAKMT2AMEN1TSHRHDAC1
SCHEMBL29344019 0.83 GAA (0.47) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL29344051 0.79 GAA (0.47) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL18650529 0.78 GAA (0.46) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL29936806 0.78 OPRD1 (0.42) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL30998427 0.77 GAA (0.40) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL30998403 0.77 GAA (0.40) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL30998426 0.77 GAA (0.40) GAANPFFR1NPFFR2OPRD1OPRK1
SCHEMBL30998391 0.77 GAA (0.40) GAANPFFR1NPFFR2OPRD1OPRK1

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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT TAIHO PHARMACEUTICAL CO., LTD. (JP) 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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT KRAS, NRAS, HRAS GAA 1240/4885NPFFR1 4758/4885NPFFR2 4721/4885

“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.