SCHEMBL25847360

SCHEMBL25847360

CCNC(=O)Oc1cccc(C(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCHE P06276 6/20 0.51
ACHE P22303 6/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
FAAH O00519 1/20 0.47
PTGS2 P35354 1/20 0.46
ALDH1A1 P00352 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL11795691 0.87 ACHE (0.48) BCHEACHESMN1; SMN2FAAHPTGS2
SCHEMBL18306927 0.86 ACHE (0.71) BCHEACHEFAAH
SCHEMBL12043574 0.86 ACHE (0.71) BCHEACHEFAAH
SCHEMBL5933261 0.83 ACHE (0.71) BCHEACHESMN1; SMN2FAAHALDH1A1
SCHEMBL29358693 0.83 ACHE (0.71) BCHEACHESMN1; SMN2FAAHALDH1A1
SCHEMBL25820322 0.81 ACHE (0.54) BCHEACHESMN1; SMN2FAAHALDH1A1
SCHEMBL5702187 0.80 LMNA (0.59) FAAHALDH1A1KMT2A
SCHEMBL17026959 0.80 ACHE (0.58) BCHEACHESMN1; SMN2FAAHALDH1A1
SCHEMBL5702214 0.80 MTNR1B (0.56)
SCHEMBL5702146 0.80 CYP3A4 (0.59) ACHE

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-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 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-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA BCHE 3202/4885ACHE 4354/4885SMN1; SMN2 2169/4885

“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.